USER MOD reduce.3.24.130724 H: found=0, std=0, add=1287, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1279 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: B 569 HIS HD1 : B 569 HIS ND1 : B 701 ZNZN :(H bumps) USER MOD NoAdj-H: B 572 HIS HD1 : B 572 HIS ND1 : B 701 ZNZN :(H bumps) USER MOD Set 1.1: B 562 THR OG1 : rot 180:sc= 0.0113 USER MOD Set 1.2: B 567 LYS NZ :NH3+ 144:sc= 0.00316 (180deg=0) USER MOD Set 2.1: A 74 LYS NZ :NH3+ -177:sc= -1.22 (180deg=-2.01) USER MOD Set 2.2: A 82 TYR OH : rot -90:sc= 0.841 USER MOD Set 3.1: A 45 MET CE :methyl -159:sc= -1.01 (180deg=-1.91!) USER MOD Set 3.2: B 602 LYS NZ :NH3+ 173:sc= -0.0648 (180deg=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -150:sc= 0.00473 (180deg=0) USER MOD Single : A 8 MET CE :methyl -165:sc= 0 (180deg=-0.295) USER MOD Single : A 12 CYS SG : rot 180:sc= -0.57 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 43:sc= 0.235 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 23 HIS : no HD1:sc= -3.24! C(o=-3.2!,f=-4.5!) USER MOD Single : A 25 THR OG1 : rot 98:sc= -0.338! USER MOD Single : A 28 ASN : amide:sc= -2.98! K(o=-3!,f=-1.5) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 THR OG1 : rot -169:sc= -2.14 USER MOD Single : A 40 HIS : no HD1:sc= -3.03 K(o=-3,f=-6.6!) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 LYS NZ :NH3+ -106:sc= -3.02! (180deg=-6!) USER MOD Single : A 55 LYS NZ :NH3+ 161:sc= -0.0107 (180deg=-0.223) USER MOD Single : A 56 LYS NZ :NH3+ 128:sc= -0.122 (180deg=-0.789) USER MOD Single : A 59 SER OG : rot 150:sc= -0.48 USER MOD Single : A 61 HIS : no HD1:sc= -9.1! C(o=-9.1!,f=-12!) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0.0625 USER MOD Single : A 75 THR OG1 : rot -126:sc= 0.295 USER MOD Single : A 76 HIS : no HD1:sc= -0.0503 K(o=-0.05,f=-4.1!) USER MOD Single : A 78 THR OG1 : rot -170:sc= -0.142 USER MOD Single : A 81 LYS NZ :NH3+ 160:sc= -0.0392 (180deg=-0.335) USER MOD Single : A 85 GLN : amide:sc= -2.95! K(o=-3!,f=-1.5) USER MOD Single : A 89 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.123) USER MOD Single : A 91 GLN : amide:sc= -6.83! C(o=-6.8!,f=-9.1!) USER MOD Single : A 93 THR OG1 : rot 180:sc= -0.601 USER MOD Single : B 541 TYR OH : rot 180:sc= 0 USER MOD Single : B 542 HIS : no HD1:sc= -0.497 K(o=-0.5,f=-1.5!) USER MOD Single : B 547 SER OG : rot 39:sc= 1.21 USER MOD Single : B 550 SER OG : rot 130:sc= 0 USER MOD Single : B 553 GLN : amide:sc= -3.46! K(o=-3.5!,f=-1.2) USER MOD Single : B 554 LYS NZ :NH3+ 145:sc= -0.309 (180deg=-1.34!) USER MOD Single : B 557 THR OG1 : rot 59:sc= 0.999 USER MOD Single : B 560 CYS SG : rot 35:sc= 0.328 USER MOD Single : B 564 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 566 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 580 LYS NZ :NH3+ 157:sc= -0.105 (180deg=-0.984) USER MOD Single : B 581 GLN : amide:sc= -6.04! C(o=-6!,f=-2.5!) USER MOD Single : B 583 ASN : amide:sc= -2.06! C(o=-2.1!,f=-3.8!) USER MOD Single : B 584 LYS NZ :NH3+ -143:sc= -8.25! (180deg=-9.36!) USER MOD Single : B 586 THR OG1 : rot 68:sc= 0.492 USER MOD Single : B 588 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 590 GLN : amide:sc= -0.791! C(o=-0.79!,f=-4.5!) USER MOD Single : B 591 ASN : amide:sc= -12.1! C(o=-12!,f=-7.5!) USER MOD Single : B 593 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00318) USER MOD Single : B 595 TYR OH : rot 180:sc= 0 USER MOD Single : B 597 GLN : amide:sc= -4.33! K(o=-4.3!,f=-0.047) USER MOD Single : B 598 ASN : amide:sc= -0.503 X(o=-0.5,f=-0.43) USER MOD Single : B 605 CYS SG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 93.370 -22.518 7.618 1.00 0.00 N ATOM 2 CA MET A 1 94.375 -22.201 6.565 1.00 0.00 C ATOM 3 C MET A 1 95.009 -23.509 6.065 1.00 0.00 C ATOM 4 O MET A 1 94.324 -24.479 5.806 1.00 0.00 O ATOM 5 CB MET A 1 95.451 -21.268 7.162 1.00 0.00 C ATOM 6 CG MET A 1 96.021 -20.330 6.083 1.00 0.00 C ATOM 7 SD MET A 1 96.226 -21.215 4.515 1.00 0.00 S ATOM 8 CE MET A 1 95.935 -19.808 3.415 1.00 0.00 C ATOM 0 H1 MET A 1 92.616 -21.802 7.605 1.00 0.00 H new ATOM 0 H2 MET A 1 92.960 -23.456 7.436 1.00 0.00 H new ATOM 0 H3 MET A 1 93.832 -22.517 8.550 1.00 0.00 H new ATOM 0 HA MET A 1 93.899 -21.698 5.724 1.00 0.00 H new ATOM 0 HB2 MET A 1 95.019 -20.679 7.971 1.00 0.00 H new ATOM 0 HB3 MET A 1 96.255 -21.863 7.595 1.00 0.00 H new ATOM 0 HG2 MET A 1 95.354 -19.480 5.943 1.00 0.00 H new ATOM 0 HG3 MET A 1 96.981 -19.931 6.410 1.00 0.00 H new ATOM 0 HE1 MET A 1 96.015 -20.134 2.378 1.00 0.00 H new ATOM 0 HE2 MET A 1 94.937 -19.407 3.593 1.00 0.00 H new ATOM 0 HE3 MET A 1 96.677 -19.034 3.610 1.00 0.00 H new ATOM 18 N ALA A 2 96.308 -23.544 5.929 1.00 0.00 N ATOM 19 CA ALA A 2 96.990 -24.783 5.448 1.00 0.00 C ATOM 20 C ALA A 2 98.316 -24.926 6.186 1.00 0.00 C ATOM 21 O ALA A 2 98.590 -25.929 6.815 1.00 0.00 O ATOM 22 CB ALA A 2 97.259 -24.662 3.950 1.00 0.00 C ATOM 0 H ALA A 2 96.931 -22.762 6.132 1.00 0.00 H new ATOM 0 HA ALA A 2 96.360 -25.653 5.635 1.00 0.00 H new ATOM 0 HB1 ALA A 2 97.757 -25.565 3.596 1.00 0.00 H new ATOM 0 HB2 ALA A 2 96.315 -24.536 3.420 1.00 0.00 H new ATOM 0 HB3 ALA A 2 97.898 -23.799 3.764 1.00 0.00 H new ATOM 28 N LEU A 3 99.132 -23.913 6.119 1.00 0.00 N ATOM 29 CA LEU A 3 100.447 -23.937 6.817 1.00 0.00 C ATOM 30 C LEU A 3 100.266 -24.500 8.218 1.00 0.00 C ATOM 31 O LEU A 3 100.526 -25.654 8.492 1.00 0.00 O ATOM 32 CB LEU A 3 100.945 -22.500 6.948 1.00 0.00 C ATOM 33 CG LEU A 3 101.445 -21.994 5.592 1.00 0.00 C ATOM 34 CD1 LEU A 3 101.696 -20.485 5.684 1.00 0.00 C ATOM 35 CD2 LEU A 3 102.744 -22.722 5.193 1.00 0.00 C ATOM 0 H LEU A 3 98.940 -23.055 5.602 1.00 0.00 H new ATOM 0 HA LEU A 3 101.152 -24.550 6.255 1.00 0.00 H new ATOM 0 HB2 LEU A 3 100.141 -21.859 7.311 1.00 0.00 H new ATOM 0 HB3 LEU A 3 101.748 -22.450 7.683 1.00 0.00 H new ATOM 0 HG LEU A 3 100.691 -22.196 4.831 1.00 0.00 H new ATOM 0 HD11 LEU A 3 102.052 -20.116 4.722 1.00 0.00 H new ATOM 0 HD12 LEU A 3 100.768 -19.977 5.946 1.00 0.00 H new ATOM 0 HD13 LEU A 3 102.446 -20.287 6.449 1.00 0.00 H new ATOM 0 HD21 LEU A 3 103.087 -22.351 4.227 1.00 0.00 H new ATOM 0 HD22 LEU A 3 103.511 -22.537 5.945 1.00 0.00 H new ATOM 0 HD23 LEU A 3 102.554 -23.793 5.124 1.00 0.00 H new ATOM 47 N ASP A 4 99.816 -23.662 9.094 1.00 0.00 N ATOM 48 CA ASP A 4 99.589 -24.074 10.497 1.00 0.00 C ATOM 49 C ASP A 4 100.856 -24.718 11.060 1.00 0.00 C ATOM 50 O ASP A 4 100.844 -25.334 12.108 1.00 0.00 O ATOM 51 CB ASP A 4 98.426 -25.062 10.539 1.00 0.00 C ATOM 52 CG ASP A 4 98.270 -25.630 11.950 1.00 0.00 C ATOM 53 OD1 ASP A 4 97.647 -24.972 12.768 1.00 0.00 O ATOM 54 OD2 ASP A 4 98.775 -26.715 12.191 1.00 0.00 O ATOM 0 H ASP A 4 99.591 -22.688 8.894 1.00 0.00 H new ATOM 0 HA ASP A 4 99.346 -23.203 11.106 1.00 0.00 H new ATOM 0 HB2 ASP A 4 97.505 -24.565 10.235 1.00 0.00 H new ATOM 0 HB3 ASP A 4 98.600 -25.871 9.830 1.00 0.00 H new ATOM 59 N GLY A 5 101.958 -24.551 10.393 1.00 0.00 N ATOM 60 CA GLY A 5 103.229 -25.123 10.913 1.00 0.00 C ATOM 61 C GLY A 5 103.487 -24.465 12.255 1.00 0.00 C ATOM 62 O GLY A 5 104.321 -24.875 13.038 1.00 0.00 O ATOM 0 H GLY A 5 102.036 -24.044 9.511 1.00 0.00 H new ATOM 0 HA2 GLY A 5 103.151 -26.205 11.021 1.00 0.00 H new ATOM 0 HA3 GLY A 5 104.051 -24.930 10.223 1.00 0.00 H new ATOM 66 N ILE A 6 102.748 -23.429 12.496 1.00 0.00 N ATOM 67 CA ILE A 6 102.855 -22.647 13.756 1.00 0.00 C ATOM 68 C ILE A 6 101.560 -22.858 14.535 1.00 0.00 C ATOM 69 O ILE A 6 101.351 -23.925 15.062 1.00 0.00 O ATOM 70 CB ILE A 6 103.090 -21.157 13.396 1.00 0.00 C ATOM 71 CG1 ILE A 6 102.616 -20.890 11.947 1.00 0.00 C ATOM 72 CG2 ILE A 6 104.586 -20.804 13.534 1.00 0.00 C ATOM 73 CD1 ILE A 6 103.644 -21.380 10.907 1.00 0.00 C ATOM 0 H ILE A 6 102.045 -23.076 11.847 1.00 0.00 H new ATOM 0 HA ILE A 6 103.692 -22.970 14.375 1.00 0.00 H new ATOM 0 HB ILE A 6 102.519 -20.532 14.082 1.00 0.00 H new ATOM 0 HG12 ILE A 6 101.662 -21.390 11.779 1.00 0.00 H new ATOM 0 HG13 ILE A 6 102.444 -19.822 11.812 1.00 0.00 H new ATOM 0 HG21 ILE A 6 104.737 -19.755 13.278 1.00 0.00 H new ATOM 0 HG22 ILE A 6 104.907 -20.977 14.561 1.00 0.00 H new ATOM 0 HG23 ILE A 6 105.171 -21.430 12.860 1.00 0.00 H new ATOM 0 HD11 ILE A 6 103.273 -21.174 9.903 1.00 0.00 H new ATOM 0 HD12 ILE A 6 104.590 -20.860 11.058 1.00 0.00 H new ATOM 0 HD13 ILE A 6 103.797 -22.453 11.024 1.00 0.00 H new ATOM 85 N ARG A 7 100.688 -21.885 14.620 1.00 0.00 N ATOM 86 CA ARG A 7 99.443 -22.086 15.366 1.00 0.00 C ATOM 87 C ARG A 7 98.491 -20.913 15.188 1.00 0.00 C ATOM 88 O ARG A 7 97.633 -20.928 14.327 1.00 0.00 O ATOM 89 CB ARG A 7 99.778 -22.280 16.865 1.00 0.00 C ATOM 90 CG ARG A 7 98.730 -23.179 17.490 1.00 0.00 C ATOM 91 CD ARG A 7 99.016 -24.611 17.060 1.00 0.00 C ATOM 92 NE ARG A 7 99.946 -25.249 18.035 1.00 0.00 N ATOM 93 CZ ARG A 7 100.019 -26.549 18.117 1.00 0.00 C ATOM 94 NH1 ARG A 7 100.838 -27.103 18.969 1.00 0.00 N ATOM 95 NH2 ARG A 7 99.274 -27.296 17.349 1.00 0.00 N ATOM 0 H ARG A 7 100.799 -20.963 14.198 1.00 0.00 H new ATOM 0 HA ARG A 7 98.944 -22.974 14.978 1.00 0.00 H new ATOM 0 HB2 ARG A 7 100.768 -22.722 16.976 1.00 0.00 H new ATOM 0 HB3 ARG A 7 99.800 -21.316 17.374 1.00 0.00 H new ATOM 0 HG2 ARG A 7 98.756 -23.096 18.576 1.00 0.00 H new ATOM 0 HG3 ARG A 7 97.732 -22.878 17.171 1.00 0.00 H new ATOM 0 HD2 ARG A 7 98.086 -25.177 17.005 1.00 0.00 H new ATOM 0 HD3 ARG A 7 99.455 -24.621 16.063 1.00 0.00 H new ATOM 0 HE ARG A 7 100.527 -24.668 18.639 1.00 0.00 H new ATOM 0 HH11 ARG A 7 101.420 -26.520 19.570 1.00 0.00 H new ATOM 0 HH12 ARG A 7 100.896 -28.119 19.034 1.00 0.00 H new ATOM 0 HH21 ARG A 7 98.633 -26.864 16.683 1.00 0.00 H new ATOM 0 HH22 ARG A 7 99.332 -28.312 17.414 1.00 0.00 H new ATOM 109 N MET A 8 98.588 -19.939 16.042 1.00 0.00 N ATOM 110 CA MET A 8 97.637 -18.779 15.994 1.00 0.00 C ATOM 111 C MET A 8 98.367 -17.433 15.776 1.00 0.00 C ATOM 112 O MET A 8 98.021 -16.709 14.867 1.00 0.00 O ATOM 113 CB MET A 8 96.771 -18.757 17.289 1.00 0.00 C ATOM 114 CG MET A 8 96.999 -20.039 18.122 1.00 0.00 C ATOM 115 SD MET A 8 95.538 -20.354 19.143 1.00 0.00 S ATOM 116 CE MET A 8 95.707 -18.911 20.223 1.00 0.00 C ATOM 0 H MET A 8 99.289 -19.888 16.781 1.00 0.00 H new ATOM 0 HA MET A 8 96.982 -18.912 15.133 1.00 0.00 H new ATOM 0 HB2 MET A 8 97.023 -17.880 17.886 1.00 0.00 H new ATOM 0 HB3 MET A 8 95.717 -18.671 17.026 1.00 0.00 H new ATOM 0 HG2 MET A 8 97.186 -20.887 17.463 1.00 0.00 H new ATOM 0 HG3 MET A 8 97.880 -19.925 18.753 1.00 0.00 H new ATOM 0 HE1 MET A 8 95.071 -19.036 21.099 1.00 0.00 H new ATOM 0 HE2 MET A 8 96.745 -18.813 20.540 1.00 0.00 H new ATOM 0 HE3 MET A 8 95.407 -18.014 19.681 1.00 0.00 H new ATOM 126 N PRO A 9 99.348 -17.066 16.575 1.00 0.00 N ATOM 127 CA PRO A 9 100.063 -15.760 16.396 1.00 0.00 C ATOM 128 C PRO A 9 100.699 -15.657 15.018 1.00 0.00 C ATOM 129 O PRO A 9 100.673 -14.627 14.373 1.00 0.00 O ATOM 130 CB PRO A 9 101.131 -15.780 17.497 1.00 0.00 C ATOM 131 CG PRO A 9 100.555 -16.685 18.516 1.00 0.00 C ATOM 132 CD PRO A 9 99.908 -17.803 17.715 1.00 0.00 C ATOM 0 HA PRO A 9 99.394 -14.903 16.468 1.00 0.00 H new ATOM 0 HB2 PRO A 9 102.086 -16.151 17.124 1.00 0.00 H new ATOM 0 HB3 PRO A 9 101.311 -14.784 17.900 1.00 0.00 H new ATOM 0 HG2 PRO A 9 101.325 -17.071 19.184 1.00 0.00 H new ATOM 0 HG3 PRO A 9 99.824 -16.168 19.137 1.00 0.00 H new ATOM 0 HD2 PRO A 9 100.633 -18.554 17.401 1.00 0.00 H new ATOM 0 HD3 PRO A 9 99.138 -18.322 18.285 1.00 0.00 H new ATOM 140 N ASP A 10 101.260 -16.739 14.570 1.00 0.00 N ATOM 141 CA ASP A 10 101.909 -16.777 13.228 1.00 0.00 C ATOM 142 C ASP A 10 101.090 -17.697 12.339 1.00 0.00 C ATOM 143 O ASP A 10 101.106 -17.600 11.128 1.00 0.00 O ATOM 144 CB ASP A 10 103.324 -17.328 13.374 1.00 0.00 C ATOM 145 CG ASP A 10 104.108 -17.092 12.082 1.00 0.00 C ATOM 146 OD1 ASP A 10 103.604 -17.454 11.032 1.00 0.00 O ATOM 147 OD2 ASP A 10 105.199 -16.553 12.165 1.00 0.00 O ATOM 0 H ASP A 10 101.299 -17.619 15.085 1.00 0.00 H new ATOM 0 HA ASP A 10 101.959 -15.779 12.793 1.00 0.00 H new ATOM 0 HB2 ASP A 10 103.828 -16.843 14.210 1.00 0.00 H new ATOM 0 HB3 ASP A 10 103.288 -18.394 13.599 1.00 0.00 H new ATOM 152 N GLY A 11 100.360 -18.584 12.947 1.00 0.00 N ATOM 153 CA GLY A 11 99.513 -19.519 12.166 1.00 0.00 C ATOM 154 C GLY A 11 98.230 -18.788 11.772 1.00 0.00 C ATOM 155 O GLY A 11 97.400 -19.305 11.050 1.00 0.00 O ATOM 0 H GLY A 11 100.314 -18.702 13.959 1.00 0.00 H new ATOM 0 HA2 GLY A 11 100.044 -19.860 11.277 1.00 0.00 H new ATOM 0 HA3 GLY A 11 99.279 -20.404 12.757 1.00 0.00 H new ATOM 159 N CYS A 12 98.068 -17.577 12.243 1.00 0.00 N ATOM 160 CA CYS A 12 96.848 -16.794 11.904 1.00 0.00 C ATOM 161 C CYS A 12 96.981 -15.366 12.448 1.00 0.00 C ATOM 162 O CYS A 12 97.403 -14.465 11.750 1.00 0.00 O ATOM 163 CB CYS A 12 95.635 -17.467 12.536 1.00 0.00 C ATOM 164 SG CYS A 12 94.207 -16.355 12.463 1.00 0.00 S ATOM 0 H CYS A 12 98.733 -17.098 12.850 1.00 0.00 H new ATOM 0 HA CYS A 12 96.728 -16.754 10.821 1.00 0.00 H new ATOM 0 HB2 CYS A 12 95.410 -18.397 12.013 1.00 0.00 H new ATOM 0 HB3 CYS A 12 95.851 -17.728 13.572 1.00 0.00 H new ATOM 0 HG CYS A 12 93.176 -16.936 13.001 1.00 0.00 H new ATOM 170 N TYR A 13 96.626 -15.160 13.693 1.00 0.00 N ATOM 171 CA TYR A 13 96.721 -13.800 14.300 1.00 0.00 C ATOM 172 C TYR A 13 96.321 -13.898 15.774 1.00 0.00 C ATOM 173 O TYR A 13 97.119 -13.693 16.667 1.00 0.00 O ATOM 174 CB TYR A 13 95.764 -12.830 13.572 1.00 0.00 C ATOM 175 CG TYR A 13 96.240 -11.405 13.759 1.00 0.00 C ATOM 176 CD1 TYR A 13 97.100 -10.825 12.818 1.00 0.00 C ATOM 177 CD2 TYR A 13 95.822 -10.668 14.873 1.00 0.00 C ATOM 178 CE1 TYR A 13 97.542 -9.508 12.992 1.00 0.00 C ATOM 179 CE2 TYR A 13 96.265 -9.351 15.047 1.00 0.00 C ATOM 180 CZ TYR A 13 97.125 -8.771 14.106 1.00 0.00 C ATOM 181 OH TYR A 13 97.562 -7.473 14.278 1.00 0.00 O ATOM 0 H TYR A 13 96.272 -15.884 14.318 1.00 0.00 H new ATOM 0 HA TYR A 13 97.740 -13.425 14.208 1.00 0.00 H new ATOM 0 HB2 TYR A 13 95.723 -13.073 12.510 1.00 0.00 H new ATOM 0 HB3 TYR A 13 94.753 -12.940 13.963 1.00 0.00 H new ATOM 0 HD1 TYR A 13 97.422 -11.394 11.958 1.00 0.00 H new ATOM 0 HD2 TYR A 13 95.158 -11.115 15.598 1.00 0.00 H new ATOM 0 HE1 TYR A 13 98.205 -9.061 12.266 1.00 0.00 H new ATOM 0 HE2 TYR A 13 95.943 -8.782 15.907 1.00 0.00 H new ATOM 0 HH TYR A 13 97.178 -7.105 15.101 1.00 0.00 H new ATOM 191 N ALA A 14 95.082 -14.217 16.023 1.00 0.00 N ATOM 192 CA ALA A 14 94.597 -14.343 17.424 1.00 0.00 C ATOM 193 C ALA A 14 93.180 -14.901 17.401 1.00 0.00 C ATOM 194 O ALA A 14 92.858 -15.842 18.098 1.00 0.00 O ATOM 195 CB ALA A 14 94.602 -12.970 18.098 1.00 0.00 C ATOM 0 H ALA A 14 94.378 -14.398 15.307 1.00 0.00 H new ATOM 0 HA ALA A 14 95.250 -15.012 17.984 1.00 0.00 H new ATOM 0 HB1 ALA A 14 94.246 -13.067 19.124 1.00 0.00 H new ATOM 0 HB2 ALA A 14 95.616 -12.570 18.102 1.00 0.00 H new ATOM 0 HB3 ALA A 14 93.947 -12.293 17.549 1.00 0.00 H new ATOM 201 N ASP A 15 92.330 -14.331 16.593 1.00 0.00 N ATOM 202 CA ASP A 15 90.928 -14.829 16.506 1.00 0.00 C ATOM 203 C ASP A 15 90.417 -14.665 15.071 1.00 0.00 C ATOM 204 O ASP A 15 89.273 -14.944 14.772 1.00 0.00 O ATOM 205 CB ASP A 15 90.045 -14.017 17.454 1.00 0.00 C ATOM 206 CG ASP A 15 88.707 -14.733 17.646 1.00 0.00 C ATOM 207 OD1 ASP A 15 87.684 -14.094 17.460 1.00 0.00 O ATOM 208 OD2 ASP A 15 88.727 -15.907 17.976 1.00 0.00 O ATOM 0 H ASP A 15 92.546 -13.539 15.987 1.00 0.00 H new ATOM 0 HA ASP A 15 90.896 -15.882 16.786 1.00 0.00 H new ATOM 0 HB2 ASP A 15 90.544 -13.892 18.415 1.00 0.00 H new ATOM 0 HB3 ASP A 15 89.880 -13.019 17.049 1.00 0.00 H new ATOM 213 N GLY A 16 91.256 -14.200 14.184 1.00 0.00 N ATOM 214 CA GLY A 16 90.829 -13.999 12.767 1.00 0.00 C ATOM 215 C GLY A 16 90.395 -12.550 12.593 1.00 0.00 C ATOM 216 O GLY A 16 89.733 -12.196 11.639 1.00 0.00 O ATOM 0 H GLY A 16 92.225 -13.949 14.381 1.00 0.00 H new ATOM 0 HA2 GLY A 16 91.649 -14.233 12.088 1.00 0.00 H new ATOM 0 HA3 GLY A 16 90.008 -14.672 12.520 1.00 0.00 H new ATOM 220 N THR A 17 90.764 -11.707 13.519 1.00 0.00 N ATOM 221 CA THR A 17 90.378 -10.277 13.433 1.00 0.00 C ATOM 222 C THR A 17 91.491 -9.491 12.756 1.00 0.00 C ATOM 223 O THR A 17 92.616 -9.461 13.216 1.00 0.00 O ATOM 224 CB THR A 17 90.182 -9.726 14.844 1.00 0.00 C ATOM 225 OG1 THR A 17 91.286 -10.105 15.654 1.00 0.00 O ATOM 226 CG2 THR A 17 88.897 -10.285 15.440 1.00 0.00 C ATOM 0 H THR A 17 91.321 -11.954 14.337 1.00 0.00 H new ATOM 0 HA THR A 17 89.456 -10.185 12.860 1.00 0.00 H new ATOM 0 HB THR A 17 90.115 -8.639 14.803 1.00 0.00 H new ATOM 0 HG1 THR A 17 92.118 -9.983 15.151 1.00 0.00 H new ATOM 0 HG21 THR A 17 88.761 -9.890 16.447 1.00 0.00 H new ATOM 0 HG22 THR A 17 88.051 -9.994 14.818 1.00 0.00 H new ATOM 0 HG23 THR A 17 88.959 -11.372 15.483 1.00 0.00 H new ATOM 234 N TRP A 18 91.172 -8.838 11.681 1.00 0.00 N ATOM 235 CA TRP A 18 92.177 -8.011 10.950 1.00 0.00 C ATOM 236 C TRP A 18 91.603 -6.601 10.807 1.00 0.00 C ATOM 237 O TRP A 18 90.528 -6.408 10.277 1.00 0.00 O ATOM 238 CB TRP A 18 92.463 -8.620 9.557 1.00 0.00 C ATOM 239 CG TRP A 18 91.448 -9.668 9.217 1.00 0.00 C ATOM 240 CD1 TRP A 18 90.173 -9.426 8.839 1.00 0.00 C ATOM 241 CD2 TRP A 18 91.610 -11.117 9.210 1.00 0.00 C ATOM 242 NE1 TRP A 18 89.541 -10.634 8.600 1.00 0.00 N ATOM 243 CE2 TRP A 18 90.385 -11.705 8.816 1.00 0.00 C ATOM 244 CE3 TRP A 18 92.690 -11.968 9.505 1.00 0.00 C ATOM 245 CZ2 TRP A 18 90.237 -13.089 8.718 1.00 0.00 C ATOM 246 CZ3 TRP A 18 92.545 -13.362 9.408 1.00 0.00 C ATOM 247 CH2 TRP A 18 91.320 -13.921 9.015 1.00 0.00 C ATOM 0 H TRP A 18 90.240 -8.839 11.266 1.00 0.00 H new ATOM 0 HA TRP A 18 93.118 -7.983 11.499 1.00 0.00 H new ATOM 0 HB2 TRP A 18 92.448 -7.834 8.802 1.00 0.00 H new ATOM 0 HB3 TRP A 18 93.462 -9.056 9.544 1.00 0.00 H new ATOM 0 HD1 TRP A 18 89.721 -8.450 8.740 1.00 0.00 H new ATOM 0 HE1 TRP A 18 88.570 -10.722 8.301 1.00 0.00 H new ATOM 0 HE3 TRP A 18 93.637 -11.547 9.808 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 89.292 -13.514 8.415 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 93.381 -14.006 9.637 1.00 0.00 H new ATOM 0 HH2 TRP A 18 91.214 -14.993 8.942 1.00 0.00 H new ATOM 258 N GLU A 19 92.309 -5.616 11.280 1.00 0.00 N ATOM 259 CA GLU A 19 91.796 -4.220 11.172 1.00 0.00 C ATOM 260 C GLU A 19 92.073 -3.702 9.765 1.00 0.00 C ATOM 261 O GLU A 19 93.179 -3.780 9.269 1.00 0.00 O ATOM 262 CB GLU A 19 92.470 -3.301 12.227 1.00 0.00 C ATOM 263 CG GLU A 19 93.651 -4.017 12.876 1.00 0.00 C ATOM 264 CD GLU A 19 94.679 -4.391 11.805 1.00 0.00 C ATOM 265 OE1 GLU A 19 95.252 -5.462 11.912 1.00 0.00 O ATOM 266 OE2 GLU A 19 94.875 -3.598 10.898 1.00 0.00 O ATOM 0 H GLU A 19 93.216 -5.713 11.736 1.00 0.00 H new ATOM 0 HA GLU A 19 90.723 -4.215 11.363 1.00 0.00 H new ATOM 0 HB2 GLU A 19 92.810 -2.380 11.753 1.00 0.00 H new ATOM 0 HB3 GLU A 19 91.744 -3.018 12.989 1.00 0.00 H new ATOM 0 HG2 GLU A 19 94.111 -3.374 13.626 1.00 0.00 H new ATOM 0 HG3 GLU A 19 93.307 -4.913 13.392 1.00 0.00 H new ATOM 273 N LEU A 20 91.078 -3.159 9.122 1.00 0.00 N ATOM 274 CA LEU A 20 91.293 -2.624 7.754 1.00 0.00 C ATOM 275 C LEU A 20 91.864 -1.217 7.906 1.00 0.00 C ATOM 276 O LEU A 20 91.366 -0.416 8.669 1.00 0.00 O ATOM 277 CB LEU A 20 89.941 -2.593 6.994 1.00 0.00 C ATOM 278 CG LEU A 20 90.047 -3.272 5.611 1.00 0.00 C ATOM 279 CD1 LEU A 20 91.279 -2.764 4.829 1.00 0.00 C ATOM 280 CD2 LEU A 20 90.114 -4.802 5.790 1.00 0.00 C ATOM 0 H LEU A 20 90.129 -3.064 9.485 1.00 0.00 H new ATOM 0 HA LEU A 20 91.982 -3.248 7.184 1.00 0.00 H new ATOM 0 HB2 LEU A 20 89.178 -3.095 7.588 1.00 0.00 H new ATOM 0 HB3 LEU A 20 89.618 -1.560 6.868 1.00 0.00 H new ATOM 0 HG LEU A 20 89.161 -3.015 5.031 1.00 0.00 H new ATOM 0 HD11 LEU A 20 91.325 -3.261 3.860 1.00 0.00 H new ATOM 0 HD12 LEU A 20 91.197 -1.687 4.681 1.00 0.00 H new ATOM 0 HD13 LEU A 20 92.185 -2.985 5.394 1.00 0.00 H new ATOM 0 HD21 LEU A 20 90.189 -5.280 4.813 1.00 0.00 H new ATOM 0 HD22 LEU A 20 90.988 -5.060 6.388 1.00 0.00 H new ATOM 0 HD23 LEU A 20 89.213 -5.149 6.296 1.00 0.00 H new ATOM 292 N SER A 21 92.914 -0.918 7.207 1.00 0.00 N ATOM 293 CA SER A 21 93.525 0.428 7.340 1.00 0.00 C ATOM 294 C SER A 21 92.722 1.447 6.547 1.00 0.00 C ATOM 295 O SER A 21 92.198 1.156 5.490 1.00 0.00 O ATOM 296 CB SER A 21 94.959 0.391 6.812 1.00 0.00 C ATOM 297 OG SER A 21 95.730 1.378 7.483 1.00 0.00 O ATOM 0 H SER A 21 93.377 -1.545 6.549 1.00 0.00 H new ATOM 0 HA SER A 21 93.527 0.715 8.392 1.00 0.00 H new ATOM 0 HB2 SER A 21 95.392 -0.596 6.971 1.00 0.00 H new ATOM 0 HB3 SER A 21 94.968 0.574 5.737 1.00 0.00 H new ATOM 0 HG SER A 21 96.651 1.357 7.149 1.00 0.00 H new ATOM 303 N VAL A 22 92.648 2.649 7.046 1.00 0.00 N ATOM 304 CA VAL A 22 91.906 3.722 6.325 1.00 0.00 C ATOM 305 C VAL A 22 92.724 5.008 6.360 1.00 0.00 C ATOM 306 O VAL A 22 92.818 5.677 7.370 1.00 0.00 O ATOM 307 CB VAL A 22 90.523 3.950 6.959 1.00 0.00 C ATOM 308 CG1 VAL A 22 89.925 5.275 6.466 1.00 0.00 C ATOM 309 CG2 VAL A 22 89.595 2.815 6.537 1.00 0.00 C ATOM 0 H VAL A 22 93.072 2.937 7.928 1.00 0.00 H new ATOM 0 HA VAL A 22 91.754 3.416 5.290 1.00 0.00 H new ATOM 0 HB VAL A 22 90.629 3.981 8.043 1.00 0.00 H new ATOM 0 HG11 VAL A 22 88.946 5.424 6.922 1.00 0.00 H new ATOM 0 HG12 VAL A 22 90.584 6.097 6.744 1.00 0.00 H new ATOM 0 HG13 VAL A 22 89.819 5.245 5.382 1.00 0.00 H new ATOM 0 HG21 VAL A 22 88.611 2.966 6.981 1.00 0.00 H new ATOM 0 HG22 VAL A 22 89.505 2.803 5.451 1.00 0.00 H new ATOM 0 HG23 VAL A 22 90.005 1.864 6.878 1.00 0.00 H new ATOM 319 N HIS A 23 93.294 5.366 5.249 1.00 0.00 N ATOM 320 CA HIS A 23 94.085 6.615 5.188 1.00 0.00 C ATOM 321 C HIS A 23 93.101 7.771 5.099 1.00 0.00 C ATOM 322 O HIS A 23 92.525 8.034 4.062 1.00 0.00 O ATOM 323 CB HIS A 23 94.971 6.577 3.937 1.00 0.00 C ATOM 324 CG HIS A 23 96.270 5.875 4.243 1.00 0.00 C ATOM 325 ND1 HIS A 23 97.471 6.259 3.667 1.00 0.00 N ATOM 326 CD2 HIS A 23 96.569 4.814 5.062 1.00 0.00 C ATOM 327 CE1 HIS A 23 98.428 5.441 4.143 1.00 0.00 C ATOM 328 NE2 HIS A 23 97.932 4.542 4.997 1.00 0.00 N ATOM 0 H HIS A 23 93.244 4.842 4.375 1.00 0.00 H new ATOM 0 HA HIS A 23 94.721 6.730 6.066 1.00 0.00 H new ATOM 0 HB2 HIS A 23 94.451 6.061 3.129 1.00 0.00 H new ATOM 0 HB3 HIS A 23 95.170 7.592 3.592 1.00 0.00 H new ATOM 0 HD2 HIS A 23 95.855 4.273 5.665 1.00 0.00 H new ATOM 0 HE1 HIS A 23 99.470 5.504 3.868 1.00 0.00 H new ATOM 0 HE2 HIS A 23 98.443 3.813 5.495 1.00 0.00 H new ATOM 336 N VAL A 24 92.899 8.465 6.178 1.00 0.00 N ATOM 337 CA VAL A 24 91.955 9.594 6.148 1.00 0.00 C ATOM 338 C VAL A 24 92.583 10.690 5.293 1.00 0.00 C ATOM 339 O VAL A 24 93.554 11.308 5.669 1.00 0.00 O ATOM 340 CB VAL A 24 91.697 10.051 7.590 1.00 0.00 C ATOM 341 CG1 VAL A 24 90.350 10.776 7.680 1.00 0.00 C ATOM 342 CG2 VAL A 24 91.649 8.824 8.508 1.00 0.00 C ATOM 0 H VAL A 24 93.350 8.295 7.077 1.00 0.00 H new ATOM 0 HA VAL A 24 90.993 9.323 5.714 1.00 0.00 H new ATOM 0 HB VAL A 24 92.498 10.725 7.894 1.00 0.00 H new ATOM 0 HG11 VAL A 24 90.177 11.096 8.708 1.00 0.00 H new ATOM 0 HG12 VAL A 24 90.361 11.648 7.026 1.00 0.00 H new ATOM 0 HG13 VAL A 24 89.552 10.101 7.371 1.00 0.00 H new ATOM 0 HG21 VAL A 24 91.466 9.144 9.534 1.00 0.00 H new ATOM 0 HG22 VAL A 24 90.847 8.160 8.186 1.00 0.00 H new ATOM 0 HG23 VAL A 24 92.600 8.294 8.458 1.00 0.00 H new ATOM 352 N THR A 25 92.063 10.887 4.110 1.00 0.00 N ATOM 353 CA THR A 25 92.651 11.897 3.185 1.00 0.00 C ATOM 354 C THR A 25 92.308 13.322 3.633 1.00 0.00 C ATOM 355 O THR A 25 93.179 14.090 3.990 1.00 0.00 O ATOM 356 CB THR A 25 92.107 11.650 1.772 1.00 0.00 C ATOM 357 OG1 THR A 25 90.778 12.145 1.686 1.00 0.00 O ATOM 358 CG2 THR A 25 92.116 10.145 1.468 1.00 0.00 C ATOM 0 H THR A 25 91.252 10.388 3.744 1.00 0.00 H new ATOM 0 HA THR A 25 93.736 11.795 3.194 1.00 0.00 H new ATOM 0 HB THR A 25 92.736 12.165 1.047 1.00 0.00 H new ATOM 0 HG1 THR A 25 90.787 13.037 1.279 1.00 0.00 H new ATOM 0 HG21 THR A 25 91.729 9.974 0.463 1.00 0.00 H new ATOM 0 HG22 THR A 25 93.136 9.767 1.533 1.00 0.00 H new ATOM 0 HG23 THR A 25 91.489 9.624 2.192 1.00 0.00 H new ATOM 366 N ASP A 26 91.056 13.689 3.605 1.00 0.00 N ATOM 367 CA ASP A 26 90.673 15.074 4.018 1.00 0.00 C ATOM 368 C ASP A 26 91.365 15.439 5.337 1.00 0.00 C ATOM 369 O ASP A 26 91.389 16.585 5.741 1.00 0.00 O ATOM 370 CB ASP A 26 89.153 15.145 4.199 1.00 0.00 C ATOM 371 CG ASP A 26 88.697 16.606 4.178 1.00 0.00 C ATOM 372 OD1 ASP A 26 87.822 16.944 4.957 1.00 0.00 O ATOM 373 OD2 ASP A 26 89.231 17.361 3.381 1.00 0.00 O ATOM 0 H ASP A 26 90.281 13.093 3.315 1.00 0.00 H new ATOM 0 HA ASP A 26 90.985 15.779 3.247 1.00 0.00 H new ATOM 0 HB2 ASP A 26 88.656 14.588 3.405 1.00 0.00 H new ATOM 0 HB3 ASP A 26 88.867 14.679 5.142 1.00 0.00 H new ATOM 378 N LEU A 27 91.924 14.468 6.009 1.00 0.00 N ATOM 379 CA LEU A 27 92.620 14.726 7.311 1.00 0.00 C ATOM 380 C LEU A 27 94.117 14.491 7.131 1.00 0.00 C ATOM 381 O LEU A 27 94.935 15.272 7.568 1.00 0.00 O ATOM 382 CB LEU A 27 92.110 13.713 8.340 1.00 0.00 C ATOM 383 CG LEU A 27 90.873 14.227 9.078 1.00 0.00 C ATOM 384 CD1 LEU A 27 91.192 15.495 9.890 1.00 0.00 C ATOM 385 CD2 LEU A 27 89.766 14.500 8.065 1.00 0.00 C ATOM 0 H LEU A 27 91.930 13.493 5.710 1.00 0.00 H new ATOM 0 HA LEU A 27 92.430 15.749 7.637 1.00 0.00 H new ATOM 0 HB2 LEU A 27 91.871 12.775 7.839 1.00 0.00 H new ATOM 0 HB3 LEU A 27 92.899 13.497 9.060 1.00 0.00 H new ATOM 0 HG LEU A 27 90.542 13.466 9.785 1.00 0.00 H new ATOM 0 HD11 LEU A 27 90.292 15.835 10.402 1.00 0.00 H new ATOM 0 HD12 LEU A 27 91.966 15.272 10.625 1.00 0.00 H new ATOM 0 HD13 LEU A 27 91.545 16.278 9.219 1.00 0.00 H new ATOM 0 HD21 LEU A 27 88.880 14.867 8.584 1.00 0.00 H new ATOM 0 HD22 LEU A 27 90.104 15.250 7.350 1.00 0.00 H new ATOM 0 HD23 LEU A 27 89.521 13.579 7.536 1.00 0.00 H new ATOM 397 N ASN A 28 94.440 13.372 6.528 1.00 0.00 N ATOM 398 CA ASN A 28 95.857 12.938 6.307 1.00 0.00 C ATOM 399 C ASN A 28 96.219 11.949 7.412 1.00 0.00 C ATOM 400 O ASN A 28 97.371 11.624 7.619 1.00 0.00 O ATOM 401 CB ASN A 28 96.843 14.116 6.337 1.00 0.00 C ATOM 402 CG ASN A 28 98.156 13.686 5.691 1.00 0.00 C ATOM 403 OD1 ASN A 28 98.948 14.507 5.276 1.00 0.00 O ATOM 404 ND2 ASN A 28 98.413 12.417 5.594 1.00 0.00 N ATOM 0 H ASN A 28 93.749 12.715 6.165 1.00 0.00 H new ATOM 0 HA ASN A 28 95.931 12.485 5.318 1.00 0.00 H new ATOM 0 HB2 ASN A 28 96.424 14.970 5.805 1.00 0.00 H new ATOM 0 HB3 ASN A 28 97.017 14.435 7.365 1.00 0.00 H new ATOM 0 HD21 ASN A 28 99.285 12.104 5.167 1.00 0.00 H new ATOM 0 HD22 ASN A 28 97.743 11.733 5.945 1.00 0.00 H new ATOM 411 N ARG A 29 95.236 11.470 8.136 1.00 0.00 N ATOM 412 CA ARG A 29 95.512 10.512 9.231 1.00 0.00 C ATOM 413 C ARG A 29 95.348 9.095 8.723 1.00 0.00 C ATOM 414 O ARG A 29 95.059 8.852 7.568 1.00 0.00 O ATOM 415 CB ARG A 29 94.513 10.710 10.363 1.00 0.00 C ATOM 416 CG ARG A 29 94.554 12.166 10.860 1.00 0.00 C ATOM 417 CD ARG A 29 93.196 12.562 11.465 1.00 0.00 C ATOM 418 NE ARG A 29 93.133 12.108 12.887 1.00 0.00 N ATOM 419 CZ ARG A 29 92.682 10.917 13.189 1.00 0.00 C ATOM 420 NH1 ARG A 29 92.639 10.539 14.437 1.00 0.00 N ATOM 421 NH2 ARG A 29 92.272 10.106 12.251 1.00 0.00 N ATOM 0 H ARG A 29 94.252 11.708 8.008 1.00 0.00 H new ATOM 0 HA ARG A 29 96.529 10.682 9.585 1.00 0.00 H new ATOM 0 HB2 ARG A 29 93.509 10.464 10.018 1.00 0.00 H new ATOM 0 HB3 ARG A 29 94.744 10.031 11.184 1.00 0.00 H new ATOM 0 HG2 ARG A 29 95.340 12.281 11.607 1.00 0.00 H new ATOM 0 HG3 ARG A 29 94.800 12.833 10.034 1.00 0.00 H new ATOM 0 HD2 ARG A 29 93.063 13.642 11.411 1.00 0.00 H new ATOM 0 HD3 ARG A 29 92.385 12.112 10.892 1.00 0.00 H new ATOM 0 HE ARG A 29 93.445 12.733 13.630 1.00 0.00 H new ATOM 0 HH11 ARG A 29 92.956 11.171 15.172 1.00 0.00 H new ATOM 0 HH12 ARG A 29 92.288 9.612 14.677 1.00 0.00 H new ATOM 0 HH21 ARG A 29 92.302 10.399 11.274 1.00 0.00 H new ATOM 0 HH22 ARG A 29 91.922 9.180 12.495 1.00 0.00 H new ATOM 435 N ASP A 30 95.501 8.162 9.606 1.00 0.00 N ATOM 436 CA ASP A 30 95.329 6.732 9.246 1.00 0.00 C ATOM 437 C ASP A 30 94.568 6.054 10.367 1.00 0.00 C ATOM 438 O ASP A 30 95.031 5.974 11.488 1.00 0.00 O ATOM 439 CB ASP A 30 96.685 6.058 9.069 1.00 0.00 C ATOM 440 CG ASP A 30 97.336 6.541 7.772 1.00 0.00 C ATOM 441 OD1 ASP A 30 97.173 7.706 7.449 1.00 0.00 O ATOM 442 OD2 ASP A 30 97.988 5.739 7.124 1.00 0.00 O ATOM 0 H ASP A 30 95.743 8.330 10.583 1.00 0.00 H new ATOM 0 HA ASP A 30 94.783 6.652 8.306 1.00 0.00 H new ATOM 0 HB2 ASP A 30 97.329 6.287 9.918 1.00 0.00 H new ATOM 0 HB3 ASP A 30 96.563 4.975 9.045 1.00 0.00 H new ATOM 447 N VAL A 31 93.391 5.577 10.072 1.00 0.00 N ATOM 448 CA VAL A 31 92.560 4.908 11.112 1.00 0.00 C ATOM 449 C VAL A 31 92.421 3.432 10.773 1.00 0.00 C ATOM 450 O VAL A 31 92.553 3.026 9.635 1.00 0.00 O ATOM 451 CB VAL A 31 91.177 5.558 11.157 1.00 0.00 C ATOM 452 CG1 VAL A 31 90.382 4.928 12.300 1.00 0.00 C ATOM 453 CG2 VAL A 31 91.320 7.076 11.391 1.00 0.00 C ATOM 0 H VAL A 31 92.965 5.622 9.146 1.00 0.00 H new ATOM 0 HA VAL A 31 93.039 5.013 12.086 1.00 0.00 H new ATOM 0 HB VAL A 31 90.659 5.399 10.211 1.00 0.00 H new ATOM 0 HG11 VAL A 31 89.391 5.380 12.347 1.00 0.00 H new ATOM 0 HG12 VAL A 31 90.284 3.856 12.127 1.00 0.00 H new ATOM 0 HG13 VAL A 31 90.903 5.097 13.242 1.00 0.00 H new ATOM 0 HG21 VAL A 31 90.331 7.534 11.422 1.00 0.00 H new ATOM 0 HG22 VAL A 31 91.831 7.252 12.337 1.00 0.00 H new ATOM 0 HG23 VAL A 31 91.898 7.516 10.579 1.00 0.00 H new ATOM 463 N THR A 32 92.164 2.627 11.764 1.00 0.00 N ATOM 464 CA THR A 32 92.018 1.157 11.542 1.00 0.00 C ATOM 465 C THR A 32 90.781 0.664 12.302 1.00 0.00 C ATOM 466 O THR A 32 90.576 0.993 13.454 1.00 0.00 O ATOM 467 CB THR A 32 93.290 0.447 12.072 1.00 0.00 C ATOM 468 OG1 THR A 32 94.125 1.411 12.696 1.00 0.00 O ATOM 469 CG2 THR A 32 94.074 -0.224 10.934 1.00 0.00 C ATOM 0 H THR A 32 92.047 2.926 12.732 1.00 0.00 H new ATOM 0 HA THR A 32 91.898 0.937 10.481 1.00 0.00 H new ATOM 0 HB THR A 32 92.984 -0.323 12.780 1.00 0.00 H new ATOM 0 HG1 THR A 32 94.933 0.973 13.037 1.00 0.00 H new ATOM 0 HG21 THR A 32 94.960 -0.712 11.341 1.00 0.00 H new ATOM 0 HG22 THR A 32 93.443 -0.966 10.445 1.00 0.00 H new ATOM 0 HG23 THR A 32 94.377 0.530 10.207 1.00 0.00 H new ATOM 477 N LEU A 33 89.966 -0.128 11.660 1.00 0.00 N ATOM 478 CA LEU A 33 88.734 -0.662 12.307 1.00 0.00 C ATOM 479 C LEU A 33 88.870 -2.177 12.462 1.00 0.00 C ATOM 480 O LEU A 33 88.880 -2.908 11.497 1.00 0.00 O ATOM 481 CB LEU A 33 87.540 -0.342 11.396 1.00 0.00 C ATOM 482 CG LEU A 33 86.984 1.074 11.668 1.00 0.00 C ATOM 483 CD1 LEU A 33 86.118 1.085 12.933 1.00 0.00 C ATOM 484 CD2 LEU A 33 88.127 2.085 11.830 1.00 0.00 C ATOM 0 H LEU A 33 90.105 -0.433 10.697 1.00 0.00 H new ATOM 0 HA LEU A 33 88.588 -0.212 13.289 1.00 0.00 H new ATOM 0 HB2 LEU A 33 87.846 -0.420 10.353 1.00 0.00 H new ATOM 0 HB3 LEU A 33 86.753 -1.080 11.553 1.00 0.00 H new ATOM 0 HG LEU A 33 86.372 1.358 10.812 1.00 0.00 H new ATOM 0 HD11 LEU A 33 85.737 2.092 13.105 1.00 0.00 H new ATOM 0 HD12 LEU A 33 85.282 0.398 12.807 1.00 0.00 H new ATOM 0 HD13 LEU A 33 86.718 0.773 13.788 1.00 0.00 H new ATOM 0 HD21 LEU A 33 87.713 3.075 12.021 1.00 0.00 H new ATOM 0 HD22 LEU A 33 88.759 1.789 12.667 1.00 0.00 H new ATOM 0 HD23 LEU A 33 88.722 2.110 10.917 1.00 0.00 H new ATOM 496 N ARG A 34 88.954 -2.643 13.674 1.00 0.00 N ATOM 497 CA ARG A 34 89.079 -4.101 13.923 1.00 0.00 C ATOM 498 C ARG A 34 87.856 -4.799 13.349 1.00 0.00 C ATOM 499 O ARG A 34 86.763 -4.693 13.870 1.00 0.00 O ATOM 500 CB ARG A 34 89.142 -4.348 15.430 1.00 0.00 C ATOM 501 CG ARG A 34 89.487 -5.818 15.697 1.00 0.00 C ATOM 502 CD ARG A 34 90.936 -6.119 15.284 1.00 0.00 C ATOM 503 NE ARG A 34 91.480 -7.201 16.153 1.00 0.00 N ATOM 504 CZ ARG A 34 92.756 -7.478 16.132 1.00 0.00 C ATOM 505 NH1 ARG A 34 93.231 -8.421 16.899 1.00 0.00 N ATOM 506 NH2 ARG A 34 93.555 -6.815 15.342 1.00 0.00 N ATOM 0 H ARG A 34 88.941 -2.065 14.515 1.00 0.00 H new ATOM 0 HA ARG A 34 89.983 -4.487 13.453 1.00 0.00 H new ATOM 0 HB2 ARG A 34 89.892 -3.700 15.884 1.00 0.00 H new ATOM 0 HB3 ARG A 34 88.185 -4.099 15.890 1.00 0.00 H new ATOM 0 HG2 ARG A 34 89.351 -6.042 16.755 1.00 0.00 H new ATOM 0 HG3 ARG A 34 88.804 -6.463 15.144 1.00 0.00 H new ATOM 0 HD2 ARG A 34 90.973 -6.424 14.238 1.00 0.00 H new ATOM 0 HD3 ARG A 34 91.547 -5.221 15.376 1.00 0.00 H new ATOM 0 HE ARG A 34 90.855 -7.726 16.765 1.00 0.00 H new ATOM 0 HH11 ARG A 34 92.606 -8.941 17.514 1.00 0.00 H new ATOM 0 HH12 ARG A 34 94.228 -8.638 16.883 1.00 0.00 H new ATOM 0 HH21 ARG A 34 93.183 -6.080 14.740 1.00 0.00 H new ATOM 0 HH22 ARG A 34 94.552 -7.032 15.326 1.00 0.00 H new ATOM 520 N VAL A 35 88.035 -5.500 12.263 1.00 0.00 N ATOM 521 CA VAL A 35 86.892 -6.204 11.614 1.00 0.00 C ATOM 522 C VAL A 35 87.295 -7.622 11.241 1.00 0.00 C ATOM 523 O VAL A 35 88.343 -8.110 11.616 1.00 0.00 O ATOM 524 CB VAL A 35 86.507 -5.465 10.337 1.00 0.00 C ATOM 525 CG1 VAL A 35 85.883 -4.120 10.698 1.00 0.00 C ATOM 526 CG2 VAL A 35 87.752 -5.234 9.477 1.00 0.00 C ATOM 0 H VAL A 35 88.933 -5.616 11.793 1.00 0.00 H new ATOM 0 HA VAL A 35 86.054 -6.230 12.310 1.00 0.00 H new ATOM 0 HB VAL A 35 85.789 -6.064 9.777 1.00 0.00 H new ATOM 0 HG11 VAL A 35 85.607 -3.590 9.786 1.00 0.00 H new ATOM 0 HG12 VAL A 35 84.993 -4.283 11.306 1.00 0.00 H new ATOM 0 HG13 VAL A 35 86.602 -3.524 11.260 1.00 0.00 H new ATOM 0 HG21 VAL A 35 87.472 -4.706 8.566 1.00 0.00 H new ATOM 0 HG22 VAL A 35 88.474 -4.638 10.035 1.00 0.00 H new ATOM 0 HG23 VAL A 35 88.198 -6.194 9.217 1.00 0.00 H new ATOM 536 N THR A 36 86.462 -8.277 10.485 1.00 0.00 N ATOM 537 CA THR A 36 86.754 -9.663 10.044 1.00 0.00 C ATOM 538 C THR A 36 86.247 -9.800 8.612 1.00 0.00 C ATOM 539 O THR A 36 85.614 -8.909 8.087 1.00 0.00 O ATOM 540 CB THR A 36 86.023 -10.660 10.949 1.00 0.00 C ATOM 541 OG1 THR A 36 84.690 -10.216 11.159 1.00 0.00 O ATOM 542 CG2 THR A 36 86.735 -10.774 12.296 1.00 0.00 C ATOM 0 H THR A 36 85.575 -7.901 10.149 1.00 0.00 H new ATOM 0 HA THR A 36 87.823 -9.869 10.098 1.00 0.00 H new ATOM 0 HB THR A 36 86.018 -11.637 10.466 1.00 0.00 H new ATOM 0 HG1 THR A 36 84.275 -10.750 11.869 1.00 0.00 H new ATOM 0 HG21 THR A 36 86.205 -11.486 12.929 1.00 0.00 H new ATOM 0 HG22 THR A 36 87.757 -11.119 12.139 1.00 0.00 H new ATOM 0 HG23 THR A 36 86.752 -9.799 12.782 1.00 0.00 H new ATOM 550 N GLY A 37 86.513 -10.892 7.968 1.00 0.00 N ATOM 551 CA GLY A 37 86.035 -11.050 6.572 1.00 0.00 C ATOM 552 C GLY A 37 84.560 -11.424 6.582 1.00 0.00 C ATOM 553 O GLY A 37 84.127 -12.323 5.889 1.00 0.00 O ATOM 0 H GLY A 37 87.039 -11.681 8.344 1.00 0.00 H new ATOM 0 HA2 GLY A 37 86.183 -10.123 6.018 1.00 0.00 H new ATOM 0 HA3 GLY A 37 86.614 -11.821 6.063 1.00 0.00 H new ATOM 557 N GLU A 38 83.784 -10.728 7.363 1.00 0.00 N ATOM 558 CA GLU A 38 82.328 -11.015 7.431 1.00 0.00 C ATOM 559 C GLU A 38 81.578 -9.715 7.720 1.00 0.00 C ATOM 560 O GLU A 38 80.377 -9.714 7.906 1.00 0.00 O ATOM 561 CB GLU A 38 82.051 -12.018 8.549 1.00 0.00 C ATOM 562 CG GLU A 38 82.782 -11.582 9.819 1.00 0.00 C ATOM 563 CD GLU A 38 82.175 -12.287 11.036 1.00 0.00 C ATOM 564 OE1 GLU A 38 82.146 -11.680 12.094 1.00 0.00 O ATOM 565 OE2 GLU A 38 81.751 -13.421 10.888 1.00 0.00 O ATOM 0 H GLU A 38 84.101 -9.966 7.962 1.00 0.00 H new ATOM 0 HA GLU A 38 81.994 -11.435 6.482 1.00 0.00 H new ATOM 0 HB2 GLU A 38 80.979 -12.082 8.737 1.00 0.00 H new ATOM 0 HB3 GLU A 38 82.382 -13.013 8.250 1.00 0.00 H new ATOM 0 HG2 GLU A 38 83.842 -11.822 9.740 1.00 0.00 H new ATOM 0 HG3 GLU A 38 82.708 -10.501 9.939 1.00 0.00 H new ATOM 572 N VAL A 39 82.271 -8.597 7.759 1.00 0.00 N ATOM 573 CA VAL A 39 81.573 -7.307 8.036 1.00 0.00 C ATOM 574 C VAL A 39 81.119 -6.661 6.726 1.00 0.00 C ATOM 575 O VAL A 39 81.792 -6.723 5.723 1.00 0.00 O ATOM 576 CB VAL A 39 82.514 -6.360 8.794 1.00 0.00 C ATOM 577 CG1 VAL A 39 83.276 -7.161 9.848 1.00 0.00 C ATOM 578 CG2 VAL A 39 83.510 -5.681 7.834 1.00 0.00 C ATOM 0 H VAL A 39 83.278 -8.527 7.612 1.00 0.00 H new ATOM 0 HA VAL A 39 80.694 -7.503 8.651 1.00 0.00 H new ATOM 0 HB VAL A 39 81.921 -5.579 9.270 1.00 0.00 H new ATOM 0 HG11 VAL A 39 83.948 -6.498 10.393 1.00 0.00 H new ATOM 0 HG12 VAL A 39 82.569 -7.613 10.544 1.00 0.00 H new ATOM 0 HG13 VAL A 39 83.856 -7.945 9.360 1.00 0.00 H new ATOM 0 HG21 VAL A 39 84.164 -5.016 8.398 1.00 0.00 H new ATOM 0 HG22 VAL A 39 84.110 -6.442 7.334 1.00 0.00 H new ATOM 0 HG23 VAL A 39 82.962 -5.104 7.089 1.00 0.00 H new ATOM 588 N HIS A 40 79.993 -6.019 6.734 1.00 0.00 N ATOM 589 CA HIS A 40 79.512 -5.349 5.490 1.00 0.00 C ATOM 590 C HIS A 40 80.159 -3.962 5.394 1.00 0.00 C ATOM 591 O HIS A 40 80.398 -3.316 6.394 1.00 0.00 O ATOM 592 CB HIS A 40 77.987 -5.210 5.547 1.00 0.00 C ATOM 593 CG HIS A 40 77.567 -4.840 6.943 1.00 0.00 C ATOM 594 ND1 HIS A 40 77.624 -5.740 7.996 1.00 0.00 N ATOM 595 CD2 HIS A 40 77.079 -3.672 7.474 1.00 0.00 C ATOM 596 CE1 HIS A 40 77.183 -5.104 9.097 1.00 0.00 C ATOM 597 NE2 HIS A 40 76.838 -3.841 8.834 1.00 0.00 N ATOM 0 H HIS A 40 79.380 -5.925 7.544 1.00 0.00 H new ATOM 0 HA HIS A 40 79.784 -5.940 4.615 1.00 0.00 H new ATOM 0 HB2 HIS A 40 77.654 -4.448 4.842 1.00 0.00 H new ATOM 0 HB3 HIS A 40 77.515 -6.147 5.250 1.00 0.00 H new ATOM 0 HD2 HIS A 40 76.908 -2.761 6.920 1.00 0.00 H new ATOM 0 HE1 HIS A 40 77.116 -5.559 10.074 1.00 0.00 H new ATOM 0 HE2 HIS A 40 76.476 -3.149 9.489 1.00 0.00 H new ATOM 605 N ILE A 41 80.444 -3.492 4.204 1.00 0.00 N ATOM 606 CA ILE A 41 81.068 -2.139 4.071 1.00 0.00 C ATOM 607 C ILE A 41 80.271 -1.149 4.912 1.00 0.00 C ATOM 608 O ILE A 41 80.799 -0.452 5.755 1.00 0.00 O ATOM 609 CB ILE A 41 81.017 -1.682 2.616 1.00 0.00 C ATOM 610 CG1 ILE A 41 81.689 -2.720 1.717 1.00 0.00 C ATOM 611 CG2 ILE A 41 81.747 -0.346 2.469 1.00 0.00 C ATOM 612 CD1 ILE A 41 81.445 -2.368 0.242 1.00 0.00 C ATOM 0 H ILE A 41 80.273 -3.982 3.326 1.00 0.00 H new ATOM 0 HA ILE A 41 82.105 -2.187 4.404 1.00 0.00 H new ATOM 0 HB ILE A 41 79.974 -1.567 2.320 1.00 0.00 H new ATOM 0 HG12 ILE A 41 82.759 -2.752 1.920 1.00 0.00 H new ATOM 0 HG13 ILE A 41 81.294 -3.712 1.934 1.00 0.00 H new ATOM 0 HG21 ILE A 41 81.708 -0.023 1.429 1.00 0.00 H new ATOM 0 HG22 ILE A 41 81.267 0.402 3.099 1.00 0.00 H new ATOM 0 HG23 ILE A 41 82.787 -0.464 2.774 1.00 0.00 H new ATOM 0 HD11 ILE A 41 81.926 -3.111 -0.394 1.00 0.00 H new ATOM 0 HD12 ILE A 41 80.373 -2.359 0.043 1.00 0.00 H new ATOM 0 HD13 ILE A 41 81.862 -1.384 0.029 1.00 0.00 H new ATOM 624 N GLY A 42 78.991 -1.102 4.684 1.00 0.00 N ATOM 625 CA GLY A 42 78.121 -0.181 5.459 1.00 0.00 C ATOM 626 C GLY A 42 78.352 -0.443 6.935 1.00 0.00 C ATOM 627 O GLY A 42 77.998 0.343 7.792 1.00 0.00 O ATOM 0 H GLY A 42 78.506 -1.668 3.987 1.00 0.00 H new ATOM 0 HA2 GLY A 42 78.353 0.856 5.216 1.00 0.00 H new ATOM 0 HA3 GLY A 42 77.074 -0.342 5.203 1.00 0.00 H new ATOM 631 N GLY A 43 78.963 -1.549 7.228 1.00 0.00 N ATOM 632 CA GLY A 43 79.248 -1.892 8.642 1.00 0.00 C ATOM 633 C GLY A 43 80.439 -1.062 9.111 1.00 0.00 C ATOM 634 O GLY A 43 80.552 -0.706 10.263 1.00 0.00 O ATOM 0 H GLY A 43 79.280 -2.236 6.544 1.00 0.00 H new ATOM 0 HA2 GLY A 43 78.376 -1.689 9.264 1.00 0.00 H new ATOM 0 HA3 GLY A 43 79.467 -2.956 8.737 1.00 0.00 H new ATOM 638 N VAL A 44 81.324 -0.745 8.208 1.00 0.00 N ATOM 639 CA VAL A 44 82.517 0.072 8.563 1.00 0.00 C ATOM 640 C VAL A 44 82.122 1.556 8.532 1.00 0.00 C ATOM 641 O VAL A 44 82.470 2.314 9.415 1.00 0.00 O ATOM 642 CB VAL A 44 83.635 -0.229 7.544 1.00 0.00 C ATOM 643 CG1 VAL A 44 84.641 0.927 7.485 1.00 0.00 C ATOM 644 CG2 VAL A 44 84.371 -1.507 7.960 1.00 0.00 C ATOM 0 H VAL A 44 81.271 -1.021 7.227 1.00 0.00 H new ATOM 0 HA VAL A 44 82.880 -0.170 9.562 1.00 0.00 H new ATOM 0 HB VAL A 44 83.182 -0.355 6.561 1.00 0.00 H new ATOM 0 HG11 VAL A 44 85.421 0.694 6.760 1.00 0.00 H new ATOM 0 HG12 VAL A 44 84.128 1.841 7.185 1.00 0.00 H new ATOM 0 HG13 VAL A 44 85.090 1.069 8.468 1.00 0.00 H new ATOM 0 HG21 VAL A 44 85.162 -1.722 7.241 1.00 0.00 H new ATOM 0 HG22 VAL A 44 84.807 -1.370 8.949 1.00 0.00 H new ATOM 0 HG23 VAL A 44 83.668 -2.340 7.986 1.00 0.00 H new ATOM 654 N MET A 45 81.383 1.974 7.532 1.00 0.00 N ATOM 655 CA MET A 45 80.954 3.406 7.466 1.00 0.00 C ATOM 656 C MET A 45 80.405 3.809 8.836 1.00 0.00 C ATOM 657 O MET A 45 80.598 4.914 9.301 1.00 0.00 O ATOM 658 CB MET A 45 79.838 3.560 6.406 1.00 0.00 C ATOM 659 CG MET A 45 80.419 3.817 4.986 1.00 0.00 C ATOM 660 SD MET A 45 79.745 2.616 3.806 1.00 0.00 S ATOM 661 CE MET A 45 78.026 3.178 3.853 1.00 0.00 C ATOM 0 H MET A 45 81.060 1.388 6.762 1.00 0.00 H new ATOM 0 HA MET A 45 81.799 4.039 7.195 1.00 0.00 H new ATOM 0 HB2 MET A 45 79.225 2.659 6.390 1.00 0.00 H new ATOM 0 HB3 MET A 45 79.183 4.385 6.685 1.00 0.00 H new ATOM 0 HG2 MET A 45 80.176 4.830 4.664 1.00 0.00 H new ATOM 0 HG3 MET A 45 81.506 3.742 5.011 1.00 0.00 H new ATOM 0 HE1 MET A 45 77.372 2.378 3.506 1.00 0.00 H new ATOM 0 HE2 MET A 45 77.759 3.448 4.875 1.00 0.00 H new ATOM 0 HE3 MET A 45 77.910 4.048 3.206 1.00 0.00 H new ATOM 671 N LEU A 46 79.713 2.910 9.475 1.00 0.00 N ATOM 672 CA LEU A 46 79.132 3.222 10.810 1.00 0.00 C ATOM 673 C LEU A 46 80.247 3.336 11.864 1.00 0.00 C ATOM 674 O LEU A 46 80.418 4.361 12.491 1.00 0.00 O ATOM 675 CB LEU A 46 78.157 2.096 11.209 1.00 0.00 C ATOM 676 CG LEU A 46 77.071 2.642 12.166 1.00 0.00 C ATOM 677 CD1 LEU A 46 75.918 3.261 11.365 1.00 0.00 C ATOM 678 CD2 LEU A 46 76.520 1.504 13.033 1.00 0.00 C ATOM 0 H LEU A 46 79.524 1.969 9.130 1.00 0.00 H new ATOM 0 HA LEU A 46 78.602 4.173 10.758 1.00 0.00 H new ATOM 0 HB2 LEU A 46 77.689 1.678 10.318 1.00 0.00 H new ATOM 0 HB3 LEU A 46 78.704 1.286 11.692 1.00 0.00 H new ATOM 0 HG LEU A 46 77.522 3.405 12.800 1.00 0.00 H new ATOM 0 HD11 LEU A 46 75.161 3.641 12.051 1.00 0.00 H new ATOM 0 HD12 LEU A 46 76.298 4.080 10.754 1.00 0.00 H new ATOM 0 HD13 LEU A 46 75.475 2.502 10.720 1.00 0.00 H new ATOM 0 HD21 LEU A 46 75.756 1.895 13.704 1.00 0.00 H new ATOM 0 HD22 LEU A 46 76.083 0.738 12.393 1.00 0.00 H new ATOM 0 HD23 LEU A 46 77.329 1.068 13.619 1.00 0.00 H new ATOM 690 N LYS A 47 80.986 2.279 12.080 1.00 0.00 N ATOM 691 CA LYS A 47 82.065 2.307 13.118 1.00 0.00 C ATOM 692 C LYS A 47 83.029 3.477 12.900 1.00 0.00 C ATOM 693 O LYS A 47 83.218 4.302 13.772 1.00 0.00 O ATOM 694 CB LYS A 47 82.872 1.008 13.072 1.00 0.00 C ATOM 695 CG LYS A 47 81.937 -0.199 13.138 1.00 0.00 C ATOM 696 CD LYS A 47 82.734 -1.478 12.849 1.00 0.00 C ATOM 697 CE LYS A 47 81.776 -2.655 12.647 1.00 0.00 C ATOM 698 NZ LYS A 47 81.177 -3.038 13.956 1.00 0.00 N ATOM 0 H LYS A 47 80.890 1.394 11.582 1.00 0.00 H new ATOM 0 HA LYS A 47 81.577 2.423 14.086 1.00 0.00 H new ATOM 0 HB2 LYS A 47 83.462 0.970 12.156 1.00 0.00 H new ATOM 0 HB3 LYS A 47 83.575 0.979 13.905 1.00 0.00 H new ATOM 0 HG2 LYS A 47 81.474 -0.261 14.123 1.00 0.00 H new ATOM 0 HG3 LYS A 47 81.131 -0.088 12.413 1.00 0.00 H new ATOM 0 HD2 LYS A 47 83.348 -1.341 11.959 1.00 0.00 H new ATOM 0 HD3 LYS A 47 83.413 -1.688 13.675 1.00 0.00 H new ATOM 0 HE2 LYS A 47 80.991 -2.382 11.942 1.00 0.00 H new ATOM 0 HE3 LYS A 47 82.310 -3.503 12.217 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 80.526 -3.838 13.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 81.932 -3.315 14.615 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 80.654 -2.229 14.348 1.00 0.00 H new ATOM 712 N LEU A 48 83.672 3.537 11.764 1.00 0.00 N ATOM 713 CA LEU A 48 84.658 4.636 11.522 1.00 0.00 C ATOM 714 C LEU A 48 84.070 5.979 11.970 1.00 0.00 C ATOM 715 O LEU A 48 84.729 6.771 12.616 1.00 0.00 O ATOM 716 CB LEU A 48 85.021 4.682 10.027 1.00 0.00 C ATOM 717 CG LEU A 48 86.066 5.779 9.739 1.00 0.00 C ATOM 718 CD1 LEU A 48 87.440 5.382 10.275 1.00 0.00 C ATOM 719 CD2 LEU A 48 86.195 5.958 8.235 1.00 0.00 C ATOM 0 H LEU A 48 83.559 2.877 10.995 1.00 0.00 H new ATOM 0 HA LEU A 48 85.561 4.444 12.101 1.00 0.00 H new ATOM 0 HB2 LEU A 48 85.412 3.713 9.715 1.00 0.00 H new ATOM 0 HB3 LEU A 48 84.123 4.868 9.438 1.00 0.00 H new ATOM 0 HG LEU A 48 85.736 6.697 10.225 1.00 0.00 H new ATOM 0 HD11 LEU A 48 88.158 6.173 10.058 1.00 0.00 H new ATOM 0 HD12 LEU A 48 87.380 5.231 11.353 1.00 0.00 H new ATOM 0 HD13 LEU A 48 87.764 4.458 9.797 1.00 0.00 H new ATOM 0 HD21 LEU A 48 86.932 6.732 8.023 1.00 0.00 H new ATOM 0 HD22 LEU A 48 86.514 5.019 7.783 1.00 0.00 H new ATOM 0 HD23 LEU A 48 85.231 6.251 7.819 1.00 0.00 H new ATOM 731 N VAL A 49 82.840 6.239 11.641 1.00 0.00 N ATOM 732 CA VAL A 49 82.210 7.527 12.054 1.00 0.00 C ATOM 733 C VAL A 49 81.964 7.512 13.568 1.00 0.00 C ATOM 734 O VAL A 49 82.264 8.464 14.261 1.00 0.00 O ATOM 735 CB VAL A 49 80.880 7.694 11.304 1.00 0.00 C ATOM 736 CG1 VAL A 49 80.010 8.770 11.965 1.00 0.00 C ATOM 737 CG2 VAL A 49 81.162 8.100 9.855 1.00 0.00 C ATOM 0 H VAL A 49 82.239 5.616 11.102 1.00 0.00 H new ATOM 0 HA VAL A 49 82.869 8.361 11.812 1.00 0.00 H new ATOM 0 HB VAL A 49 80.346 6.744 11.334 1.00 0.00 H new ATOM 0 HG11 VAL A 49 79.074 8.869 11.415 1.00 0.00 H new ATOM 0 HG12 VAL A 49 79.797 8.484 12.995 1.00 0.00 H new ATOM 0 HG13 VAL A 49 80.539 9.723 11.955 1.00 0.00 H new ATOM 0 HG21 VAL A 49 80.220 8.219 9.321 1.00 0.00 H new ATOM 0 HG22 VAL A 49 81.709 9.043 9.841 1.00 0.00 H new ATOM 0 HG23 VAL A 49 81.759 7.327 9.370 1.00 0.00 H new ATOM 747 N GLU A 50 81.412 6.443 14.083 1.00 0.00 N ATOM 748 CA GLU A 50 81.138 6.369 15.551 1.00 0.00 C ATOM 749 C GLU A 50 82.352 6.881 16.327 1.00 0.00 C ATOM 750 O GLU A 50 82.224 7.537 17.343 1.00 0.00 O ATOM 751 CB GLU A 50 80.872 4.913 15.947 1.00 0.00 C ATOM 752 CG GLU A 50 79.456 4.507 15.532 1.00 0.00 C ATOM 753 CD GLU A 50 78.434 5.241 16.403 1.00 0.00 C ATOM 754 OE1 GLU A 50 77.370 5.555 15.897 1.00 0.00 O ATOM 755 OE2 GLU A 50 78.735 5.477 17.562 1.00 0.00 O ATOM 0 H GLU A 50 81.139 5.617 13.550 1.00 0.00 H new ATOM 0 HA GLU A 50 80.268 6.982 15.785 1.00 0.00 H new ATOM 0 HB2 GLU A 50 81.601 4.259 15.469 1.00 0.00 H new ATOM 0 HB3 GLU A 50 80.993 4.793 17.024 1.00 0.00 H new ATOM 0 HG2 GLU A 50 79.292 4.746 14.481 1.00 0.00 H new ATOM 0 HG3 GLU A 50 79.331 3.429 15.637 1.00 0.00 H new ATOM 762 N LYS A 51 83.526 6.581 15.857 1.00 0.00 N ATOM 763 CA LYS A 51 84.748 7.040 16.564 1.00 0.00 C ATOM 764 C LYS A 51 84.907 8.551 16.385 1.00 0.00 C ATOM 765 O LYS A 51 85.371 9.246 17.267 1.00 0.00 O ATOM 766 CB LYS A 51 85.952 6.308 15.991 1.00 0.00 C ATOM 767 CG LYS A 51 85.692 4.805 16.104 1.00 0.00 C ATOM 768 CD LYS A 51 86.976 4.010 15.854 1.00 0.00 C ATOM 769 CE LYS A 51 87.714 4.540 14.619 1.00 0.00 C ATOM 770 NZ LYS A 51 88.461 5.778 14.978 1.00 0.00 N ATOM 0 H LYS A 51 83.693 6.036 15.011 1.00 0.00 H new ATOM 0 HA LYS A 51 84.669 6.823 17.629 1.00 0.00 H new ATOM 0 HB2 LYS A 51 86.109 6.590 14.950 1.00 0.00 H new ATOM 0 HB3 LYS A 51 86.857 6.580 16.535 1.00 0.00 H new ATOM 0 HG2 LYS A 51 85.302 4.572 17.095 1.00 0.00 H new ATOM 0 HG3 LYS A 51 84.929 4.508 15.384 1.00 0.00 H new ATOM 0 HD2 LYS A 51 87.625 4.076 16.727 1.00 0.00 H new ATOM 0 HD3 LYS A 51 86.735 2.956 15.715 1.00 0.00 H new ATOM 0 HE2 LYS A 51 88.403 3.784 14.242 1.00 0.00 H new ATOM 0 HE3 LYS A 51 87.003 4.751 13.820 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 87.972 6.606 14.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 88.508 5.867 16.013 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 89.425 5.726 14.591 1.00 0.00 H new ATOM 784 N LEU A 52 84.510 9.066 15.253 1.00 0.00 N ATOM 785 CA LEU A 52 84.619 10.525 15.013 1.00 0.00 C ATOM 786 C LEU A 52 83.713 11.250 16.009 1.00 0.00 C ATOM 787 O LEU A 52 84.173 11.927 16.905 1.00 0.00 O ATOM 788 CB LEU A 52 84.173 10.813 13.566 1.00 0.00 C ATOM 789 CG LEU A 52 84.882 12.069 13.029 1.00 0.00 C ATOM 790 CD1 LEU A 52 86.279 11.701 12.507 1.00 0.00 C ATOM 791 CD2 LEU A 52 84.068 12.686 11.882 1.00 0.00 C ATOM 0 H LEU A 52 84.112 8.531 14.481 1.00 0.00 H new ATOM 0 HA LEU A 52 85.644 10.872 15.148 1.00 0.00 H new ATOM 0 HB2 LEU A 52 84.402 9.958 12.930 1.00 0.00 H new ATOM 0 HB3 LEU A 52 83.093 10.954 13.532 1.00 0.00 H new ATOM 0 HG LEU A 52 84.971 12.790 13.842 1.00 0.00 H new ATOM 0 HD11 LEU A 52 86.773 12.596 12.129 1.00 0.00 H new ATOM 0 HD12 LEU A 52 86.870 11.275 13.318 1.00 0.00 H new ATOM 0 HD13 LEU A 52 86.186 10.971 11.703 1.00 0.00 H new ATOM 0 HD21 LEU A 52 84.579 13.574 11.510 1.00 0.00 H new ATOM 0 HD22 LEU A 52 83.968 11.960 11.075 1.00 0.00 H new ATOM 0 HD23 LEU A 52 83.078 12.963 12.246 1.00 0.00 H new ATOM 803 N ASP A 53 82.433 11.086 15.855 1.00 0.00 N ATOM 804 CA ASP A 53 81.456 11.719 16.779 1.00 0.00 C ATOM 805 C ASP A 53 81.480 13.227 16.628 1.00 0.00 C ATOM 806 O ASP A 53 82.058 13.941 17.423 1.00 0.00 O ATOM 807 CB ASP A 53 81.806 11.329 18.205 1.00 0.00 C ATOM 808 CG ASP A 53 80.578 11.472 19.111 1.00 0.00 C ATOM 809 OD1 ASP A 53 80.306 12.583 19.535 1.00 0.00 O ATOM 810 OD2 ASP A 53 79.934 10.468 19.364 1.00 0.00 O ATOM 0 H ASP A 53 82.013 10.528 15.112 1.00 0.00 H new ATOM 0 HA ASP A 53 80.451 11.372 16.537 1.00 0.00 H new ATOM 0 HB2 ASP A 53 82.167 10.301 18.230 1.00 0.00 H new ATOM 0 HB3 ASP A 53 82.614 11.960 18.574 1.00 0.00 H new ATOM 815 N VAL A 54 80.848 13.707 15.613 1.00 0.00 N ATOM 816 CA VAL A 54 80.816 15.171 15.386 1.00 0.00 C ATOM 817 C VAL A 54 79.847 15.493 14.249 1.00 0.00 C ATOM 818 O VAL A 54 79.661 14.711 13.339 1.00 0.00 O ATOM 819 CB VAL A 54 82.228 15.630 15.042 1.00 0.00 C ATOM 820 CG1 VAL A 54 82.785 14.723 13.952 1.00 0.00 C ATOM 821 CG2 VAL A 54 82.208 17.084 14.559 1.00 0.00 C ATOM 0 H VAL A 54 80.346 13.149 14.922 1.00 0.00 H new ATOM 0 HA VAL A 54 80.472 15.692 16.280 1.00 0.00 H new ATOM 0 HB VAL A 54 82.860 15.572 15.928 1.00 0.00 H new ATOM 0 HG11 VAL A 54 83.796 15.040 13.696 1.00 0.00 H new ATOM 0 HG12 VAL A 54 82.808 13.694 14.311 1.00 0.00 H new ATOM 0 HG13 VAL A 54 82.150 14.785 13.068 1.00 0.00 H new ATOM 0 HG21 VAL A 54 83.222 17.401 14.316 1.00 0.00 H new ATOM 0 HG22 VAL A 54 81.581 17.164 13.671 1.00 0.00 H new ATOM 0 HG23 VAL A 54 81.807 17.723 15.345 1.00 0.00 H new ATOM 831 N LYS A 55 79.226 16.640 14.294 1.00 0.00 N ATOM 832 CA LYS A 55 78.264 17.011 13.217 1.00 0.00 C ATOM 833 C LYS A 55 79.039 17.242 11.911 1.00 0.00 C ATOM 834 O LYS A 55 78.683 18.079 11.106 1.00 0.00 O ATOM 835 CB LYS A 55 77.513 18.300 13.636 1.00 0.00 C ATOM 836 CG LYS A 55 76.042 18.322 13.108 1.00 0.00 C ATOM 837 CD LYS A 55 75.887 19.320 11.947 1.00 0.00 C ATOM 838 CE LYS A 55 74.401 19.498 11.629 1.00 0.00 C ATOM 839 NZ LYS A 55 73.769 20.349 12.677 1.00 0.00 N ATOM 0 H LYS A 55 79.343 17.336 15.030 1.00 0.00 H new ATOM 0 HA LYS A 55 77.539 16.212 13.062 1.00 0.00 H new ATOM 0 HB2 LYS A 55 77.509 18.379 14.723 1.00 0.00 H new ATOM 0 HB3 LYS A 55 78.047 19.170 13.255 1.00 0.00 H new ATOM 0 HG2 LYS A 55 75.757 17.324 12.775 1.00 0.00 H new ATOM 0 HG3 LYS A 55 75.365 18.593 13.918 1.00 0.00 H new ATOM 0 HD2 LYS A 55 76.331 20.279 12.215 1.00 0.00 H new ATOM 0 HD3 LYS A 55 76.418 18.957 11.067 1.00 0.00 H new ATOM 0 HE2 LYS A 55 74.280 19.959 10.649 1.00 0.00 H new ATOM 0 HE3 LYS A 55 73.908 18.527 11.587 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 72.874 20.736 12.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 73.582 19.775 13.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 74.410 21.130 12.923 1.00 0.00 H new ATOM 853 N LYS A 56 80.096 16.503 11.700 1.00 0.00 N ATOM 854 CA LYS A 56 80.892 16.676 10.456 1.00 0.00 C ATOM 855 C LYS A 56 80.171 15.986 9.300 1.00 0.00 C ATOM 856 O LYS A 56 79.277 15.188 9.501 1.00 0.00 O ATOM 857 CB LYS A 56 82.275 16.044 10.652 1.00 0.00 C ATOM 858 CG LYS A 56 83.205 16.458 9.505 1.00 0.00 C ATOM 859 CD LYS A 56 84.639 16.018 9.820 1.00 0.00 C ATOM 860 CE LYS A 56 85.612 16.715 8.867 1.00 0.00 C ATOM 861 NZ LYS A 56 85.603 18.182 9.134 1.00 0.00 N ATOM 0 H LYS A 56 80.441 15.786 12.339 1.00 0.00 H new ATOM 0 HA LYS A 56 81.006 17.737 10.232 1.00 0.00 H new ATOM 0 HB2 LYS A 56 82.697 16.360 11.606 1.00 0.00 H new ATOM 0 HB3 LYS A 56 82.187 14.958 10.686 1.00 0.00 H new ATOM 0 HG2 LYS A 56 82.872 16.004 8.572 1.00 0.00 H new ATOM 0 HG3 LYS A 56 83.168 17.538 9.365 1.00 0.00 H new ATOM 0 HD2 LYS A 56 84.887 16.264 10.853 1.00 0.00 H new ATOM 0 HD3 LYS A 56 84.728 14.936 9.720 1.00 0.00 H new ATOM 0 HE2 LYS A 56 86.618 16.316 9.001 1.00 0.00 H new ATOM 0 HE3 LYS A 56 85.327 16.521 7.833 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 86.578 18.515 9.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 85.180 18.680 8.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 85.045 18.376 9.990 1.00 0.00 H new ATOM 875 N ASP A 57 80.550 16.288 8.093 1.00 0.00 N ATOM 876 CA ASP A 57 79.889 15.655 6.927 1.00 0.00 C ATOM 877 C ASP A 57 80.433 14.241 6.750 1.00 0.00 C ATOM 878 O ASP A 57 81.418 14.022 6.074 1.00 0.00 O ATOM 879 CB ASP A 57 80.177 16.483 5.672 1.00 0.00 C ATOM 880 CG ASP A 57 80.062 17.972 6.005 1.00 0.00 C ATOM 881 OD1 ASP A 57 79.008 18.375 6.469 1.00 0.00 O ATOM 882 OD2 ASP A 57 81.029 18.683 5.790 1.00 0.00 O ATOM 0 H ASP A 57 81.292 16.949 7.865 1.00 0.00 H new ATOM 0 HA ASP A 57 78.812 15.611 7.089 1.00 0.00 H new ATOM 0 HB2 ASP A 57 81.176 16.259 5.297 1.00 0.00 H new ATOM 0 HB3 ASP A 57 79.474 16.221 4.881 1.00 0.00 H new ATOM 887 N TRP A 58 79.795 13.278 7.348 1.00 0.00 N ATOM 888 CA TRP A 58 80.266 11.880 7.214 1.00 0.00 C ATOM 889 C TRP A 58 79.954 11.389 5.801 1.00 0.00 C ATOM 890 O TRP A 58 80.807 10.886 5.098 1.00 0.00 O ATOM 891 CB TRP A 58 79.523 10.999 8.215 1.00 0.00 C ATOM 892 CG TRP A 58 79.699 11.492 9.620 1.00 0.00 C ATOM 893 CD1 TRP A 58 80.825 12.042 10.142 1.00 0.00 C ATOM 894 CD2 TRP A 58 78.722 11.468 10.700 1.00 0.00 C ATOM 895 NE1 TRP A 58 80.592 12.352 11.471 1.00 0.00 N ATOM 896 CE2 TRP A 58 79.311 12.017 11.860 1.00 0.00 C ATOM 897 CE3 TRP A 58 77.391 11.024 10.779 1.00 0.00 C ATOM 898 CZ2 TRP A 58 78.603 12.121 13.059 1.00 0.00 C ATOM 899 CZ3 TRP A 58 76.677 11.128 11.983 1.00 0.00 C ATOM 900 CH2 TRP A 58 77.282 11.674 13.121 1.00 0.00 C ATOM 0 H TRP A 58 78.964 13.402 7.926 1.00 0.00 H new ATOM 0 HA TRP A 58 81.338 11.832 7.404 1.00 0.00 H new ATOM 0 HB2 TRP A 58 78.462 10.979 7.966 1.00 0.00 H new ATOM 0 HB3 TRP A 58 79.887 9.974 8.140 1.00 0.00 H new ATOM 0 HD1 TRP A 58 81.749 12.210 9.609 1.00 0.00 H new ATOM 0 HE1 TRP A 58 81.284 12.777 12.088 1.00 0.00 H new ATOM 0 HE3 TRP A 58 76.914 10.600 9.908 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 79.075 12.545 13.933 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 75.654 10.785 12.032 1.00 0.00 H new ATOM 0 HH2 TRP A 58 76.728 11.749 14.045 1.00 0.00 H new ATOM 911 N SER A 59 78.728 11.533 5.389 1.00 0.00 N ATOM 912 CA SER A 59 78.325 11.082 4.030 1.00 0.00 C ATOM 913 C SER A 59 79.325 11.583 2.997 1.00 0.00 C ATOM 914 O SER A 59 79.711 10.868 2.093 1.00 0.00 O ATOM 915 CB SER A 59 76.955 11.654 3.716 1.00 0.00 C ATOM 916 OG SER A 59 77.065 13.057 3.517 1.00 0.00 O ATOM 0 H SER A 59 77.979 11.949 5.942 1.00 0.00 H new ATOM 0 HA SER A 59 78.298 9.993 4.000 1.00 0.00 H new ATOM 0 HB2 SER A 59 76.546 11.180 2.824 1.00 0.00 H new ATOM 0 HB3 SER A 59 76.265 11.444 4.533 1.00 0.00 H new ATOM 0 HG SER A 59 76.378 13.352 2.883 1.00 0.00 H new ATOM 922 N ASP A 60 79.758 12.805 3.124 1.00 0.00 N ATOM 923 CA ASP A 60 80.741 13.346 2.151 1.00 0.00 C ATOM 924 C ASP A 60 81.946 12.406 2.082 1.00 0.00 C ATOM 925 O ASP A 60 82.850 12.601 1.296 1.00 0.00 O ATOM 926 CB ASP A 60 81.196 14.733 2.610 1.00 0.00 C ATOM 927 CG ASP A 60 82.320 15.232 1.701 1.00 0.00 C ATOM 928 OD1 ASP A 60 83.470 15.079 2.076 1.00 0.00 O ATOM 929 OD2 ASP A 60 82.011 15.760 0.645 1.00 0.00 O ATOM 0 H ASP A 60 79.473 13.451 3.860 1.00 0.00 H new ATOM 0 HA ASP A 60 80.283 13.424 1.165 1.00 0.00 H new ATOM 0 HB2 ASP A 60 80.357 15.429 2.584 1.00 0.00 H new ATOM 0 HB3 ASP A 60 81.542 14.690 3.643 1.00 0.00 H new ATOM 934 N HIS A 61 81.966 11.390 2.916 1.00 0.00 N ATOM 935 CA HIS A 61 83.100 10.426 2.935 1.00 0.00 C ATOM 936 C HIS A 61 82.597 9.010 2.603 1.00 0.00 C ATOM 937 O HIS A 61 81.427 8.701 2.709 1.00 0.00 O ATOM 938 CB HIS A 61 83.746 10.466 4.343 1.00 0.00 C ATOM 939 CG HIS A 61 83.445 9.206 5.131 1.00 0.00 C ATOM 940 ND1 HIS A 61 84.020 7.985 4.814 1.00 0.00 N ATOM 941 CD2 HIS A 61 82.629 8.966 6.209 1.00 0.00 C ATOM 942 CE1 HIS A 61 83.545 7.075 5.685 1.00 0.00 C ATOM 943 NE2 HIS A 61 82.693 7.620 6.556 1.00 0.00 N ATOM 0 H HIS A 61 81.229 11.191 3.593 1.00 0.00 H new ATOM 0 HA HIS A 61 83.842 10.698 2.184 1.00 0.00 H new ATOM 0 HB2 HIS A 61 84.825 10.586 4.246 1.00 0.00 H new ATOM 0 HB3 HIS A 61 83.377 11.334 4.889 1.00 0.00 H new ATOM 0 HD2 HIS A 61 82.028 9.710 6.712 1.00 0.00 H new ATOM 0 HE1 HIS A 61 83.820 6.031 5.680 1.00 0.00 H new ATOM 0 HE2 HIS A 61 82.196 7.151 7.313 1.00 0.00 H new ATOM 951 N ALA A 62 83.503 8.159 2.225 1.00 0.00 N ATOM 952 CA ALA A 62 83.162 6.749 1.898 1.00 0.00 C ATOM 953 C ALA A 62 84.481 5.993 1.745 1.00 0.00 C ATOM 954 O ALA A 62 85.525 6.605 1.636 1.00 0.00 O ATOM 955 CB ALA A 62 82.365 6.696 0.591 1.00 0.00 C ATOM 0 H ALA A 62 84.492 8.387 2.126 1.00 0.00 H new ATOM 0 HA ALA A 62 82.551 6.302 2.682 1.00 0.00 H new ATOM 0 HB1 ALA A 62 82.118 5.660 0.357 1.00 0.00 H new ATOM 0 HB2 ALA A 62 81.446 7.272 0.702 1.00 0.00 H new ATOM 0 HB3 ALA A 62 82.963 7.118 -0.217 1.00 0.00 H new ATOM 961 N LEU A 63 84.472 4.683 1.738 1.00 0.00 N ATOM 962 CA LEU A 63 85.769 3.949 1.593 1.00 0.00 C ATOM 963 C LEU A 63 86.017 3.634 0.125 1.00 0.00 C ATOM 964 O LEU A 63 85.149 3.166 -0.583 1.00 0.00 O ATOM 965 CB LEU A 63 85.748 2.641 2.384 1.00 0.00 C ATOM 966 CG LEU A 63 85.456 2.894 3.869 1.00 0.00 C ATOM 967 CD1 LEU A 63 86.407 3.959 4.434 1.00 0.00 C ATOM 968 CD2 LEU A 63 83.993 3.331 4.079 1.00 0.00 C ATOM 0 H LEU A 63 83.641 4.098 1.825 1.00 0.00 H new ATOM 0 HA LEU A 63 86.565 4.584 1.982 1.00 0.00 H new ATOM 0 HB2 LEU A 63 84.991 1.975 1.970 1.00 0.00 H new ATOM 0 HB3 LEU A 63 86.708 2.135 2.281 1.00 0.00 H new ATOM 0 HG LEU A 63 85.617 1.958 4.403 1.00 0.00 H new ATOM 0 HD11 LEU A 63 86.184 4.124 5.488 1.00 0.00 H new ATOM 0 HD12 LEU A 63 87.437 3.619 4.330 1.00 0.00 H new ATOM 0 HD13 LEU A 63 86.276 4.892 3.885 1.00 0.00 H new ATOM 0 HD21 LEU A 63 83.814 3.504 5.140 1.00 0.00 H new ATOM 0 HD22 LEU A 63 83.805 4.251 3.525 1.00 0.00 H new ATOM 0 HD23 LEU A 63 83.324 2.548 3.721 1.00 0.00 H new ATOM 980 N TRP A 64 87.212 3.906 -0.331 1.00 0.00 N ATOM 981 CA TRP A 64 87.577 3.649 -1.762 1.00 0.00 C ATOM 982 C TRP A 64 88.743 2.651 -1.787 1.00 0.00 C ATOM 983 O TRP A 64 89.557 2.616 -0.887 1.00 0.00 O ATOM 984 CB TRP A 64 87.924 5.025 -2.416 1.00 0.00 C ATOM 985 CG TRP A 64 89.346 5.127 -2.906 1.00 0.00 C ATOM 986 CD1 TRP A 64 90.462 4.914 -2.167 1.00 0.00 C ATOM 987 CD2 TRP A 64 89.808 5.525 -4.231 1.00 0.00 C ATOM 988 NE1 TRP A 64 91.573 5.111 -2.968 1.00 0.00 N ATOM 989 CE2 TRP A 64 91.222 5.498 -4.245 1.00 0.00 C ATOM 990 CE3 TRP A 64 89.141 5.890 -5.415 1.00 0.00 C ATOM 991 CZ2 TRP A 64 91.949 5.824 -5.391 1.00 0.00 C ATOM 992 CZ3 TRP A 64 89.869 6.223 -6.569 1.00 0.00 C ATOM 993 CH2 TRP A 64 91.271 6.191 -6.556 1.00 0.00 C ATOM 0 H TRP A 64 87.964 4.301 0.234 1.00 0.00 H new ATOM 0 HA TRP A 64 86.763 3.206 -2.335 1.00 0.00 H new ATOM 0 HB2 TRP A 64 87.248 5.199 -3.253 1.00 0.00 H new ATOM 0 HB3 TRP A 64 87.743 5.817 -1.690 1.00 0.00 H new ATOM 0 HD1 TRP A 64 90.481 4.636 -1.124 1.00 0.00 H new ATOM 0 HE1 TRP A 64 92.535 4.985 -2.653 1.00 0.00 H new ATOM 0 HE3 TRP A 64 88.061 5.914 -5.437 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 93.028 5.793 -5.377 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 89.346 6.505 -7.471 1.00 0.00 H new ATOM 0 HH2 TRP A 64 91.826 6.450 -7.446 1.00 0.00 H new ATOM 1004 N TRP A 65 88.813 1.817 -2.797 1.00 0.00 N ATOM 1005 CA TRP A 65 89.921 0.810 -2.873 1.00 0.00 C ATOM 1006 C TRP A 65 90.884 1.230 -3.981 1.00 0.00 C ATOM 1007 O TRP A 65 90.687 0.904 -5.126 1.00 0.00 O ATOM 1008 CB TRP A 65 89.342 -0.573 -3.201 1.00 0.00 C ATOM 1009 CG TRP A 65 90.360 -1.648 -2.926 1.00 0.00 C ATOM 1010 CD1 TRP A 65 91.670 -1.446 -2.622 1.00 0.00 C ATOM 1011 CD2 TRP A 65 90.169 -3.094 -2.931 1.00 0.00 C ATOM 1012 NE1 TRP A 65 92.280 -2.670 -2.437 1.00 0.00 N ATOM 1013 CE2 TRP A 65 91.401 -3.715 -2.620 1.00 0.00 C ATOM 1014 CE3 TRP A 65 89.056 -3.918 -3.174 1.00 0.00 C ATOM 1015 CZ2 TRP A 65 91.525 -5.103 -2.552 1.00 0.00 C ATOM 1016 CZ3 TRP A 65 89.178 -5.315 -3.108 1.00 0.00 C ATOM 1017 CH2 TRP A 65 90.409 -5.906 -2.798 1.00 0.00 C ATOM 0 H TRP A 65 88.151 1.789 -3.573 1.00 0.00 H new ATOM 0 HA TRP A 65 90.443 0.761 -1.917 1.00 0.00 H new ATOM 0 HB2 TRP A 65 88.447 -0.750 -2.605 1.00 0.00 H new ATOM 0 HB3 TRP A 65 89.040 -0.609 -4.248 1.00 0.00 H new ATOM 0 HD1 TRP A 65 92.154 -0.484 -2.539 1.00 0.00 H new ATOM 0 HE1 TRP A 65 93.264 -2.787 -2.194 1.00 0.00 H new ATOM 0 HE3 TRP A 65 88.101 -3.473 -3.413 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 92.477 -5.553 -2.311 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 88.317 -5.938 -3.298 1.00 0.00 H new ATOM 0 HH2 TRP A 65 90.495 -6.981 -2.749 1.00 0.00 H new ATOM 1028 N GLU A 66 91.914 1.963 -3.653 1.00 0.00 N ATOM 1029 CA GLU A 66 92.875 2.419 -4.703 1.00 0.00 C ATOM 1030 C GLU A 66 93.419 1.234 -5.494 1.00 0.00 C ATOM 1031 O GLU A 66 93.829 1.383 -6.623 1.00 0.00 O ATOM 1032 CB GLU A 66 94.035 3.162 -4.059 1.00 0.00 C ATOM 1033 CG GLU A 66 94.598 2.326 -2.915 1.00 0.00 C ATOM 1034 CD GLU A 66 95.725 3.093 -2.221 1.00 0.00 C ATOM 1035 OE1 GLU A 66 95.732 4.310 -2.316 1.00 0.00 O ATOM 1036 OE2 GLU A 66 96.561 2.452 -1.606 1.00 0.00 O ATOM 0 H GLU A 66 92.133 2.266 -2.704 1.00 0.00 H new ATOM 0 HA GLU A 66 92.342 3.083 -5.383 1.00 0.00 H new ATOM 0 HB2 GLU A 66 94.812 3.357 -4.798 1.00 0.00 H new ATOM 0 HB3 GLU A 66 93.700 4.130 -3.686 1.00 0.00 H new ATOM 0 HG2 GLU A 66 93.809 2.093 -2.200 1.00 0.00 H new ATOM 0 HG3 GLU A 66 94.973 1.376 -3.296 1.00 0.00 H new ATOM 1043 N LYS A 67 93.421 0.056 -4.943 1.00 0.00 N ATOM 1044 CA LYS A 67 93.927 -1.089 -5.744 1.00 0.00 C ATOM 1045 C LYS A 67 92.910 -1.310 -6.856 1.00 0.00 C ATOM 1046 O LYS A 67 93.103 -2.092 -7.766 1.00 0.00 O ATOM 1047 CB LYS A 67 94.036 -2.361 -4.893 1.00 0.00 C ATOM 1048 CG LYS A 67 94.767 -2.087 -3.573 1.00 0.00 C ATOM 1049 CD LYS A 67 96.205 -1.626 -3.834 1.00 0.00 C ATOM 1050 CE LYS A 67 96.990 -1.544 -2.508 1.00 0.00 C ATOM 1051 NZ LYS A 67 98.399 -1.968 -2.746 1.00 0.00 N ATOM 0 H LYS A 67 93.104 -0.162 -3.998 1.00 0.00 H new ATOM 0 HA LYS A 67 94.923 -0.873 -6.130 1.00 0.00 H new ATOM 0 HB2 LYS A 67 93.039 -2.749 -4.685 1.00 0.00 H new ATOM 0 HB3 LYS A 67 94.567 -3.131 -5.452 1.00 0.00 H new ATOM 0 HG2 LYS A 67 94.232 -1.324 -3.007 1.00 0.00 H new ATOM 0 HG3 LYS A 67 94.775 -2.990 -2.962 1.00 0.00 H new ATOM 0 HD2 LYS A 67 96.699 -2.320 -4.514 1.00 0.00 H new ATOM 0 HD3 LYS A 67 96.199 -0.651 -4.322 1.00 0.00 H new ATOM 0 HE2 LYS A 67 96.965 -0.526 -2.119 1.00 0.00 H new ATOM 0 HE3 LYS A 67 96.527 -2.184 -1.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 98.933 -1.915 -1.855 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 98.412 -2.946 -3.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 98.836 -1.340 -3.450 1.00 0.00 H new ATOM 1065 N LYS A 68 91.810 -0.611 -6.757 1.00 0.00 N ATOM 1066 CA LYS A 68 90.714 -0.723 -7.754 1.00 0.00 C ATOM 1067 C LYS A 68 90.253 0.688 -8.137 1.00 0.00 C ATOM 1068 O LYS A 68 89.505 0.873 -9.076 1.00 0.00 O ATOM 1069 CB LYS A 68 89.525 -1.488 -7.129 1.00 0.00 C ATOM 1070 CG LYS A 68 90.016 -2.589 -6.173 1.00 0.00 C ATOM 1071 CD LYS A 68 90.534 -3.779 -6.982 1.00 0.00 C ATOM 1072 CE LYS A 68 91.351 -4.717 -6.079 1.00 0.00 C ATOM 1073 NZ LYS A 68 91.230 -6.115 -6.581 1.00 0.00 N ATOM 0 H LYS A 68 91.625 0.051 -6.003 1.00 0.00 H new ATOM 0 HA LYS A 68 91.069 -1.258 -8.635 1.00 0.00 H new ATOM 0 HB2 LYS A 68 88.884 -0.791 -6.588 1.00 0.00 H new ATOM 0 HB3 LYS A 68 88.918 -1.932 -7.919 1.00 0.00 H new ATOM 0 HG2 LYS A 68 90.807 -2.201 -5.531 1.00 0.00 H new ATOM 0 HG3 LYS A 68 89.203 -2.907 -5.520 1.00 0.00 H new ATOM 0 HD2 LYS A 68 89.697 -4.322 -7.421 1.00 0.00 H new ATOM 0 HD3 LYS A 68 91.153 -3.426 -7.807 1.00 0.00 H new ATOM 0 HE2 LYS A 68 92.397 -4.411 -6.070 1.00 0.00 H new ATOM 0 HE3 LYS A 68 90.992 -4.655 -5.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 91.782 -6.752 -5.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 90.231 -6.403 -6.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 91.593 -6.167 -7.554 1.00 0.00 H new ATOM 1087 N ARG A 69 90.668 1.681 -7.389 1.00 0.00 N ATOM 1088 CA ARG A 69 90.228 3.072 -7.679 1.00 0.00 C ATOM 1089 C ARG A 69 88.707 3.060 -7.749 1.00 0.00 C ATOM 1090 O ARG A 69 88.108 3.604 -8.656 1.00 0.00 O ATOM 1091 CB ARG A 69 90.803 3.559 -9.019 1.00 0.00 C ATOM 1092 CG ARG A 69 92.306 3.885 -8.886 1.00 0.00 C ATOM 1093 CD ARG A 69 93.137 2.622 -9.110 1.00 0.00 C ATOM 1094 NE ARG A 69 93.150 2.288 -10.562 1.00 0.00 N ATOM 1095 CZ ARG A 69 93.837 1.265 -10.992 1.00 0.00 C ATOM 1096 NH1 ARG A 69 93.845 0.972 -12.264 1.00 0.00 N ATOM 1097 NH2 ARG A 69 94.515 0.534 -10.150 1.00 0.00 N ATOM 0 H ARG A 69 91.294 1.583 -6.589 1.00 0.00 H new ATOM 0 HA ARG A 69 90.583 3.747 -6.900 1.00 0.00 H new ATOM 0 HB2 ARG A 69 90.659 2.793 -9.781 1.00 0.00 H new ATOM 0 HB3 ARG A 69 90.262 4.445 -9.351 1.00 0.00 H new ATOM 0 HG2 ARG A 69 92.587 4.648 -9.612 1.00 0.00 H new ATOM 0 HG3 ARG A 69 92.511 4.295 -7.897 1.00 0.00 H new ATOM 0 HD2 ARG A 69 94.155 2.775 -8.752 1.00 0.00 H new ATOM 0 HD3 ARG A 69 92.720 1.793 -8.539 1.00 0.00 H new ATOM 0 HE ARG A 69 92.621 2.860 -11.221 1.00 0.00 H new ATOM 0 HH11 ARG A 69 93.314 1.543 -12.922 1.00 0.00 H new ATOM 0 HH12 ARG A 69 94.382 0.172 -12.600 1.00 0.00 H new ATOM 0 HH21 ARG A 69 94.508 0.762 -9.156 1.00 0.00 H new ATOM 0 HH22 ARG A 69 95.052 -0.266 -10.486 1.00 0.00 H new ATOM 1111 N THR A 70 88.082 2.412 -6.797 1.00 0.00 N ATOM 1112 CA THR A 70 86.594 2.312 -6.789 1.00 0.00 C ATOM 1113 C THR A 70 86.030 3.084 -5.609 1.00 0.00 C ATOM 1114 O THR A 70 86.745 3.723 -4.875 1.00 0.00 O ATOM 1115 CB THR A 70 86.217 0.831 -6.645 1.00 0.00 C ATOM 1116 OG1 THR A 70 84.862 0.645 -7.027 1.00 0.00 O ATOM 1117 CG2 THR A 70 86.413 0.358 -5.196 1.00 0.00 C ATOM 0 H THR A 70 88.546 1.944 -6.018 1.00 0.00 H new ATOM 0 HA THR A 70 86.188 2.727 -7.712 1.00 0.00 H new ATOM 0 HB THR A 70 86.867 0.243 -7.293 1.00 0.00 H new ATOM 0 HG1 THR A 70 84.623 -0.301 -6.936 1.00 0.00 H new ATOM 0 HG21 THR A 70 86.140 -0.694 -5.117 1.00 0.00 H new ATOM 0 HG22 THR A 70 87.457 0.484 -4.910 1.00 0.00 H new ATOM 0 HG23 THR A 70 85.781 0.948 -4.532 1.00 0.00 H new ATOM 1125 N TRP A 71 84.751 2.968 -5.402 1.00 0.00 N ATOM 1126 CA TRP A 71 84.091 3.623 -4.241 1.00 0.00 C ATOM 1127 C TRP A 71 83.280 2.537 -3.538 1.00 0.00 C ATOM 1128 O TRP A 71 82.203 2.167 -3.948 1.00 0.00 O ATOM 1129 CB TRP A 71 83.196 4.782 -4.701 1.00 0.00 C ATOM 1130 CG TRP A 71 82.490 4.477 -5.988 1.00 0.00 C ATOM 1131 CD1 TRP A 71 82.262 3.246 -6.510 1.00 0.00 C ATOM 1132 CD2 TRP A 71 81.895 5.426 -6.921 1.00 0.00 C ATOM 1133 NE1 TRP A 71 81.563 3.385 -7.684 1.00 0.00 N ATOM 1134 CE2 TRP A 71 81.316 4.706 -7.989 1.00 0.00 C ATOM 1135 CE3 TRP A 71 81.804 6.830 -6.941 1.00 0.00 C ATOM 1136 CZ2 TRP A 71 80.668 5.352 -9.042 1.00 0.00 C ATOM 1137 CZ3 TRP A 71 81.153 7.485 -8.000 1.00 0.00 C ATOM 1138 CH2 TRP A 71 80.586 6.747 -9.048 1.00 0.00 C ATOM 0 H TRP A 71 84.121 2.435 -6.002 1.00 0.00 H new ATOM 0 HA TRP A 71 84.825 4.057 -3.562 1.00 0.00 H new ATOM 0 HB2 TRP A 71 82.460 4.999 -3.927 1.00 0.00 H new ATOM 0 HB3 TRP A 71 83.802 5.679 -4.825 1.00 0.00 H new ATOM 0 HD1 TRP A 71 82.578 2.310 -6.074 1.00 0.00 H new ATOM 0 HE1 TRP A 71 81.262 2.601 -8.263 1.00 0.00 H new ATOM 0 HE3 TRP A 71 82.237 7.408 -6.138 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 80.233 4.778 -9.847 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 81.089 8.563 -8.006 1.00 0.00 H new ATOM 0 HH2 TRP A 71 80.086 7.256 -9.859 1.00 0.00 H new ATOM 1149 N LEU A 72 83.818 1.988 -2.500 1.00 0.00 N ATOM 1150 CA LEU A 72 83.120 0.878 -1.812 1.00 0.00 C ATOM 1151 C LEU A 72 81.766 1.342 -1.292 1.00 0.00 C ATOM 1152 O LEU A 72 81.593 1.677 -0.138 1.00 0.00 O ATOM 1153 CB LEU A 72 83.997 0.376 -0.672 1.00 0.00 C ATOM 1154 CG LEU A 72 85.378 -0.006 -1.229 1.00 0.00 C ATOM 1155 CD1 LEU A 72 86.383 -0.108 -0.087 1.00 0.00 C ATOM 1156 CD2 LEU A 72 85.311 -1.345 -1.979 1.00 0.00 C ATOM 0 H LEU A 72 84.714 2.258 -2.094 1.00 0.00 H new ATOM 0 HA LEU A 72 82.943 0.064 -2.514 1.00 0.00 H new ATOM 0 HB2 LEU A 72 84.100 1.148 0.091 1.00 0.00 H new ATOM 0 HB3 LEU A 72 83.533 -0.486 -0.193 1.00 0.00 H new ATOM 0 HG LEU A 72 85.695 0.768 -1.928 1.00 0.00 H new ATOM 0 HD11 LEU A 72 87.361 -0.379 -0.486 1.00 0.00 H new ATOM 0 HD12 LEU A 72 86.453 0.853 0.423 1.00 0.00 H new ATOM 0 HD13 LEU A 72 86.055 -0.871 0.619 1.00 0.00 H new ATOM 0 HD21 LEU A 72 86.299 -1.596 -2.365 1.00 0.00 H new ATOM 0 HD22 LEU A 72 84.978 -2.128 -1.297 1.00 0.00 H new ATOM 0 HD23 LEU A 72 84.608 -1.263 -2.808 1.00 0.00 H new ATOM 1168 N LEU A 73 80.801 1.327 -2.170 1.00 0.00 N ATOM 1169 CA LEU A 73 79.404 1.722 -1.815 1.00 0.00 C ATOM 1170 C LEU A 73 78.506 0.506 -2.029 1.00 0.00 C ATOM 1171 O LEU A 73 77.297 0.581 -1.928 1.00 0.00 O ATOM 1172 CB LEU A 73 78.933 2.895 -2.703 1.00 0.00 C ATOM 1173 CG LEU A 73 79.130 2.582 -4.217 1.00 0.00 C ATOM 1174 CD1 LEU A 73 77.831 2.034 -4.836 1.00 0.00 C ATOM 1175 CD2 LEU A 73 79.508 3.864 -4.974 1.00 0.00 C ATOM 0 H LEU A 73 80.924 1.051 -3.144 1.00 0.00 H new ATOM 0 HA LEU A 73 79.359 2.051 -0.777 1.00 0.00 H new ATOM 0 HB2 LEU A 73 77.881 3.101 -2.507 1.00 0.00 H new ATOM 0 HB3 LEU A 73 79.488 3.796 -2.442 1.00 0.00 H new ATOM 0 HG LEU A 73 79.922 1.838 -4.301 1.00 0.00 H new ATOM 0 HD11 LEU A 73 77.993 1.823 -5.893 1.00 0.00 H new ATOM 0 HD12 LEU A 73 77.542 1.117 -4.323 1.00 0.00 H new ATOM 0 HD13 LEU A 73 77.038 2.774 -4.731 1.00 0.00 H new ATOM 0 HD21 LEU A 73 79.644 3.636 -6.031 1.00 0.00 H new ATOM 0 HD22 LEU A 73 78.713 4.601 -4.861 1.00 0.00 H new ATOM 0 HD23 LEU A 73 80.436 4.266 -4.568 1.00 0.00 H new ATOM 1187 N LYS A 74 79.099 -0.624 -2.322 1.00 0.00 N ATOM 1188 CA LYS A 74 78.301 -1.862 -2.542 1.00 0.00 C ATOM 1189 C LYS A 74 78.014 -2.502 -1.182 1.00 0.00 C ATOM 1190 O LYS A 74 78.532 -3.555 -0.868 1.00 0.00 O ATOM 1191 CB LYS A 74 79.104 -2.847 -3.418 1.00 0.00 C ATOM 1192 CG LYS A 74 78.850 -2.573 -4.908 1.00 0.00 C ATOM 1193 CD LYS A 74 79.286 -1.150 -5.276 1.00 0.00 C ATOM 1194 CE LYS A 74 80.782 -0.960 -4.994 1.00 0.00 C ATOM 1195 NZ LYS A 74 81.517 -2.225 -5.275 1.00 0.00 N ATOM 0 H LYS A 74 80.108 -0.740 -2.418 1.00 0.00 H new ATOM 0 HA LYS A 74 77.366 -1.620 -3.047 1.00 0.00 H new ATOM 0 HB2 LYS A 74 80.168 -2.752 -3.201 1.00 0.00 H new ATOM 0 HB3 LYS A 74 78.820 -3.871 -3.177 1.00 0.00 H new ATOM 0 HG2 LYS A 74 79.397 -3.295 -5.515 1.00 0.00 H new ATOM 0 HG3 LYS A 74 77.791 -2.705 -5.132 1.00 0.00 H new ATOM 0 HD2 LYS A 74 79.081 -0.961 -6.330 1.00 0.00 H new ATOM 0 HD3 LYS A 74 78.707 -0.426 -4.704 1.00 0.00 H new ATOM 0 HE2 LYS A 74 81.178 -0.154 -5.612 1.00 0.00 H new ATOM 0 HE3 LYS A 74 80.930 -0.666 -3.955 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 82.521 -2.104 -5.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 81.114 -2.995 -4.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 81.430 -2.460 -6.284 1.00 0.00 H new ATOM 1209 N THR A 75 77.198 -1.872 -0.374 1.00 0.00 N ATOM 1210 CA THR A 75 76.879 -2.437 0.974 1.00 0.00 C ATOM 1211 C THR A 75 76.690 -3.952 0.877 1.00 0.00 C ATOM 1212 O THR A 75 77.101 -4.696 1.745 1.00 0.00 O ATOM 1213 CB THR A 75 75.593 -1.801 1.502 1.00 0.00 C ATOM 1214 OG1 THR A 75 75.708 -0.386 1.439 1.00 0.00 O ATOM 1215 CG2 THR A 75 75.368 -2.234 2.951 1.00 0.00 C ATOM 0 H THR A 75 76.738 -0.988 -0.590 1.00 0.00 H new ATOM 0 HA THR A 75 77.704 -2.221 1.653 1.00 0.00 H new ATOM 0 HB THR A 75 74.748 -2.124 0.894 1.00 0.00 H new ATOM 0 HG1 THR A 75 75.527 -0.003 2.323 1.00 0.00 H new ATOM 0 HG21 THR A 75 74.451 -1.781 3.328 1.00 0.00 H new ATOM 0 HG22 THR A 75 75.282 -3.320 2.997 1.00 0.00 H new ATOM 0 HG23 THR A 75 76.211 -1.911 3.562 1.00 0.00 H new ATOM 1223 N HIS A 76 76.079 -4.414 -0.175 1.00 0.00 N ATOM 1224 CA HIS A 76 75.877 -5.878 -0.326 1.00 0.00 C ATOM 1225 C HIS A 76 77.240 -6.572 -0.311 1.00 0.00 C ATOM 1226 O HIS A 76 78.271 -5.931 -0.337 1.00 0.00 O ATOM 1227 CB HIS A 76 75.173 -6.162 -1.655 1.00 0.00 C ATOM 1228 CG HIS A 76 73.850 -5.448 -1.687 1.00 0.00 C ATOM 1229 ND1 HIS A 76 73.750 -4.069 -1.580 1.00 0.00 N ATOM 1230 CD2 HIS A 76 72.562 -5.907 -1.814 1.00 0.00 C ATOM 1231 CE1 HIS A 76 72.445 -3.750 -1.646 1.00 0.00 C ATOM 1232 NE2 HIS A 76 71.677 -4.834 -1.788 1.00 0.00 N ATOM 0 H HIS A 76 75.711 -3.842 -0.935 1.00 0.00 H new ATOM 0 HA HIS A 76 75.263 -6.253 0.493 1.00 0.00 H new ATOM 0 HB2 HIS A 76 75.796 -5.832 -2.486 1.00 0.00 H new ATOM 0 HB3 HIS A 76 75.022 -7.235 -1.776 1.00 0.00 H new ATOM 0 HD2 HIS A 76 72.279 -6.944 -1.918 1.00 0.00 H new ATOM 0 HE1 HIS A 76 72.064 -2.741 -1.591 1.00 0.00 H new ATOM 0 HE2 HIS A 76 70.660 -4.868 -1.862 1.00 0.00 H new ATOM 1240 N TRP A 77 77.247 -7.875 -0.261 1.00 0.00 N ATOM 1241 CA TRP A 77 78.528 -8.629 -0.239 1.00 0.00 C ATOM 1242 C TRP A 77 79.379 -8.163 0.935 1.00 0.00 C ATOM 1243 O TRP A 77 79.089 -7.174 1.579 1.00 0.00 O ATOM 1244 CB TRP A 77 79.296 -8.420 -1.550 1.00 0.00 C ATOM 1245 CG TRP A 77 78.537 -8.984 -2.716 1.00 0.00 C ATOM 1246 CD1 TRP A 77 77.853 -10.158 -2.732 1.00 0.00 C ATOM 1247 CD2 TRP A 77 78.395 -8.417 -4.050 1.00 0.00 C ATOM 1248 NE1 TRP A 77 77.300 -10.334 -3.984 1.00 0.00 N ATOM 1249 CE2 TRP A 77 77.604 -9.290 -4.832 1.00 0.00 C ATOM 1250 CE3 TRP A 77 78.871 -7.237 -4.650 1.00 0.00 C ATOM 1251 CZ2 TRP A 77 77.296 -9.004 -6.163 1.00 0.00 C ATOM 1252 CZ3 TRP A 77 78.564 -6.946 -5.990 1.00 0.00 C ATOM 1253 CH2 TRP A 77 77.778 -7.828 -6.744 1.00 0.00 C ATOM 0 H TRP A 77 76.408 -8.455 -0.234 1.00 0.00 H new ATOM 0 HA TRP A 77 78.307 -9.691 -0.129 1.00 0.00 H new ATOM 0 HB2 TRP A 77 79.471 -7.356 -1.707 1.00 0.00 H new ATOM 0 HB3 TRP A 77 80.273 -8.898 -1.483 1.00 0.00 H new ATOM 0 HD1 TRP A 77 77.758 -10.841 -1.901 1.00 0.00 H new ATOM 0 HE1 TRP A 77 76.734 -11.140 -4.250 1.00 0.00 H new ATOM 0 HE3 TRP A 77 79.476 -6.550 -4.077 1.00 0.00 H new ATOM 0 HZ2 TRP A 77 76.690 -9.687 -6.740 1.00 0.00 H new ATOM 0 HZ3 TRP A 77 78.936 -6.038 -6.441 1.00 0.00 H new ATOM 0 HH2 TRP A 77 77.545 -7.599 -7.773 1.00 0.00 H new ATOM 1264 N THR A 78 80.422 -8.895 1.224 1.00 0.00 N ATOM 1265 CA THR A 78 81.319 -8.553 2.372 1.00 0.00 C ATOM 1266 C THR A 78 82.752 -8.349 1.859 1.00 0.00 C ATOM 1267 O THR A 78 82.992 -8.202 0.677 1.00 0.00 O ATOM 1268 CB THR A 78 81.271 -9.733 3.384 1.00 0.00 C ATOM 1269 OG1 THR A 78 80.213 -10.606 3.016 1.00 0.00 O ATOM 1270 CG2 THR A 78 81.032 -9.250 4.821 1.00 0.00 C ATOM 0 H THR A 78 80.696 -9.730 0.706 1.00 0.00 H new ATOM 0 HA THR A 78 80.993 -7.633 2.857 1.00 0.00 H new ATOM 0 HB THR A 78 82.235 -10.241 3.355 1.00 0.00 H new ATOM 0 HG1 THR A 78 80.069 -11.264 3.728 1.00 0.00 H new ATOM 0 HG21 THR A 78 81.006 -10.107 5.493 1.00 0.00 H new ATOM 0 HG22 THR A 78 81.839 -8.580 5.119 1.00 0.00 H new ATOM 0 HG23 THR A 78 80.081 -8.719 4.873 1.00 0.00 H new ATOM 1278 N LEU A 79 83.698 -8.355 2.754 1.00 0.00 N ATOM 1279 CA LEU A 79 85.124 -8.182 2.356 1.00 0.00 C ATOM 1280 C LEU A 79 85.555 -9.444 1.627 1.00 0.00 C ATOM 1281 O LEU A 79 85.954 -9.420 0.484 1.00 0.00 O ATOM 1282 CB LEU A 79 86.003 -8.050 3.602 1.00 0.00 C ATOM 1283 CG LEU A 79 85.838 -6.683 4.276 1.00 0.00 C ATOM 1284 CD1 LEU A 79 84.360 -6.352 4.443 1.00 0.00 C ATOM 1285 CD2 LEU A 79 86.489 -6.741 5.661 1.00 0.00 C ATOM 0 H LEU A 79 83.544 -8.474 3.755 1.00 0.00 H new ATOM 0 HA LEU A 79 85.226 -7.293 1.734 1.00 0.00 H new ATOM 0 HB2 LEU A 79 85.748 -8.838 4.311 1.00 0.00 H new ATOM 0 HB3 LEU A 79 87.048 -8.195 3.326 1.00 0.00 H new ATOM 0 HG LEU A 79 86.308 -5.917 3.659 1.00 0.00 H new ATOM 0 HD11 LEU A 79 84.257 -5.379 4.923 1.00 0.00 H new ATOM 0 HD12 LEU A 79 83.880 -6.327 3.465 1.00 0.00 H new ATOM 0 HD13 LEU A 79 83.884 -7.113 5.061 1.00 0.00 H new ATOM 0 HD21 LEU A 79 86.381 -5.775 6.155 1.00 0.00 H new ATOM 0 HD22 LEU A 79 86.003 -7.511 6.260 1.00 0.00 H new ATOM 0 HD23 LEU A 79 87.548 -6.978 5.556 1.00 0.00 H new ATOM 1297 N ASP A 80 85.464 -10.553 2.311 1.00 0.00 N ATOM 1298 CA ASP A 80 85.851 -11.860 1.715 1.00 0.00 C ATOM 1299 C ASP A 80 85.327 -11.951 0.295 1.00 0.00 C ATOM 1300 O ASP A 80 86.049 -12.246 -0.637 1.00 0.00 O ATOM 1301 CB ASP A 80 85.214 -12.969 2.538 1.00 0.00 C ATOM 1302 CG ASP A 80 85.668 -14.331 2.011 1.00 0.00 C ATOM 1303 OD1 ASP A 80 86.856 -14.490 1.784 1.00 0.00 O ATOM 1304 OD2 ASP A 80 84.820 -15.191 1.843 1.00 0.00 O ATOM 0 H ASP A 80 85.132 -10.607 3.274 1.00 0.00 H new ATOM 0 HA ASP A 80 86.937 -11.955 1.709 1.00 0.00 H new ATOM 0 HB2 ASP A 80 85.493 -12.863 3.586 1.00 0.00 H new ATOM 0 HB3 ASP A 80 84.128 -12.893 2.488 1.00 0.00 H new ATOM 1309 N LYS A 81 84.064 -11.703 0.130 1.00 0.00 N ATOM 1310 CA LYS A 81 83.464 -11.773 -1.222 1.00 0.00 C ATOM 1311 C LYS A 81 84.350 -11.019 -2.208 1.00 0.00 C ATOM 1312 O LYS A 81 84.774 -11.545 -3.218 1.00 0.00 O ATOM 1313 CB LYS A 81 82.078 -11.129 -1.200 1.00 0.00 C ATOM 1314 CG LYS A 81 81.317 -11.552 0.058 1.00 0.00 C ATOM 1315 CD LYS A 81 81.380 -13.069 0.223 1.00 0.00 C ATOM 1316 CE LYS A 81 80.363 -13.513 1.276 1.00 0.00 C ATOM 1317 NZ LYS A 81 78.987 -13.419 0.710 1.00 0.00 N ATOM 0 H LYS A 81 83.418 -11.453 0.879 1.00 0.00 H new ATOM 0 HA LYS A 81 83.378 -12.816 -1.526 1.00 0.00 H new ATOM 0 HB2 LYS A 81 82.173 -10.044 -1.228 1.00 0.00 H new ATOM 0 HB3 LYS A 81 81.519 -11.423 -2.088 1.00 0.00 H new ATOM 0 HG2 LYS A 81 81.746 -11.065 0.933 1.00 0.00 H new ATOM 0 HG3 LYS A 81 80.278 -11.228 -0.010 1.00 0.00 H new ATOM 0 HD2 LYS A 81 81.170 -13.557 -0.729 1.00 0.00 H new ATOM 0 HD3 LYS A 81 82.384 -13.371 0.522 1.00 0.00 H new ATOM 0 HE2 LYS A 81 80.570 -14.537 1.588 1.00 0.00 H new ATOM 0 HE3 LYS A 81 80.446 -12.886 2.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 78.342 -14.017 1.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 78.663 -12.432 0.748 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 78.995 -13.743 -0.278 1.00 0.00 H new ATOM 1331 N TYR A 82 84.629 -9.784 -1.912 1.00 0.00 N ATOM 1332 CA TYR A 82 85.487 -8.976 -2.819 1.00 0.00 C ATOM 1333 C TYR A 82 86.923 -9.512 -2.771 1.00 0.00 C ATOM 1334 O TYR A 82 87.577 -9.643 -3.786 1.00 0.00 O ATOM 1335 CB TYR A 82 85.455 -7.506 -2.365 1.00 0.00 C ATOM 1336 CG TYR A 82 84.266 -6.799 -2.983 1.00 0.00 C ATOM 1337 CD1 TYR A 82 83.185 -6.404 -2.184 1.00 0.00 C ATOM 1338 CD2 TYR A 82 84.250 -6.539 -4.359 1.00 0.00 C ATOM 1339 CE1 TYR A 82 82.090 -5.751 -2.762 1.00 0.00 C ATOM 1340 CE2 TYR A 82 83.155 -5.885 -4.936 1.00 0.00 C ATOM 1341 CZ TYR A 82 82.075 -5.491 -4.138 1.00 0.00 C ATOM 1342 OH TYR A 82 80.996 -4.847 -4.707 1.00 0.00 O ATOM 0 H TYR A 82 84.299 -9.297 -1.079 1.00 0.00 H new ATOM 0 HA TYR A 82 85.117 -9.044 -3.842 1.00 0.00 H new ATOM 0 HB2 TYR A 82 85.395 -7.454 -1.278 1.00 0.00 H new ATOM 0 HB3 TYR A 82 86.378 -7.006 -2.658 1.00 0.00 H new ATOM 0 HD1 TYR A 82 83.197 -6.603 -1.123 1.00 0.00 H new ATOM 0 HD2 TYR A 82 85.083 -6.843 -4.975 1.00 0.00 H new ATOM 0 HE1 TYR A 82 81.256 -5.447 -2.146 1.00 0.00 H new ATOM 0 HE2 TYR A 82 83.144 -5.684 -5.997 1.00 0.00 H new ATOM 0 HH TYR A 82 80.330 -5.509 -4.986 1.00 0.00 H new ATOM 1352 N GLY A 83 87.416 -9.815 -1.596 1.00 0.00 N ATOM 1353 CA GLY A 83 88.814 -10.337 -1.458 1.00 0.00 C ATOM 1354 C GLY A 83 89.617 -9.334 -0.641 1.00 0.00 C ATOM 1355 O GLY A 83 90.807 -9.476 -0.443 1.00 0.00 O ATOM 0 H GLY A 83 86.906 -9.723 -0.717 1.00 0.00 H new ATOM 0 HA2 GLY A 83 88.810 -11.310 -0.968 1.00 0.00 H new ATOM 0 HA3 GLY A 83 89.266 -10.477 -2.440 1.00 0.00 H new ATOM 1359 N ILE A 84 88.960 -8.316 -0.166 1.00 0.00 N ATOM 1360 CA ILE A 84 89.649 -7.282 0.646 1.00 0.00 C ATOM 1361 C ILE A 84 90.219 -7.926 1.905 1.00 0.00 C ATOM 1362 O ILE A 84 89.817 -8.999 2.303 1.00 0.00 O ATOM 1363 CB ILE A 84 88.640 -6.204 1.032 1.00 0.00 C ATOM 1364 CG1 ILE A 84 88.083 -5.542 -0.239 1.00 0.00 C ATOM 1365 CG2 ILE A 84 89.325 -5.149 1.901 1.00 0.00 C ATOM 1366 CD1 ILE A 84 86.721 -4.912 0.064 1.00 0.00 C ATOM 0 H ILE A 84 87.963 -8.156 -0.308 1.00 0.00 H new ATOM 0 HA ILE A 84 90.461 -6.836 0.072 1.00 0.00 H new ATOM 0 HB ILE A 84 87.822 -6.658 1.592 1.00 0.00 H new ATOM 0 HG12 ILE A 84 88.775 -4.780 -0.598 1.00 0.00 H new ATOM 0 HG13 ILE A 84 87.984 -6.282 -1.033 1.00 0.00 H new ATOM 0 HG21 ILE A 84 88.603 -4.380 2.176 1.00 0.00 H new ATOM 0 HG22 ILE A 84 89.716 -5.619 2.803 1.00 0.00 H new ATOM 0 HG23 ILE A 84 90.145 -4.695 1.344 1.00 0.00 H new ATOM 0 HD11 ILE A 84 86.328 -4.443 -0.838 1.00 0.00 H new ATOM 0 HD12 ILE A 84 86.030 -5.684 0.402 1.00 0.00 H new ATOM 0 HD13 ILE A 84 86.834 -4.159 0.844 1.00 0.00 H new ATOM 1378 N GLN A 85 91.155 -7.276 2.533 1.00 0.00 N ATOM 1379 CA GLN A 85 91.761 -7.841 3.769 1.00 0.00 C ATOM 1380 C GLN A 85 92.702 -6.801 4.388 1.00 0.00 C ATOM 1381 O GLN A 85 92.692 -5.640 4.029 1.00 0.00 O ATOM 1382 CB GLN A 85 92.555 -9.119 3.418 1.00 0.00 C ATOM 1383 CG GLN A 85 92.515 -10.125 4.591 1.00 0.00 C ATOM 1384 CD GLN A 85 91.287 -11.026 4.467 1.00 0.00 C ATOM 1385 OE1 GLN A 85 91.371 -12.224 4.651 1.00 0.00 O ATOM 1386 NE2 GLN A 85 90.145 -10.490 4.161 1.00 0.00 N ATOM 0 H GLN A 85 91.529 -6.373 2.242 1.00 0.00 H new ATOM 0 HA GLN A 85 90.976 -8.093 4.482 1.00 0.00 H new ATOM 0 HB2 GLN A 85 92.136 -9.579 2.523 1.00 0.00 H new ATOM 0 HB3 GLN A 85 93.589 -8.860 3.189 1.00 0.00 H new ATOM 0 HG2 GLN A 85 93.421 -10.730 4.592 1.00 0.00 H new ATOM 0 HG3 GLN A 85 92.488 -9.589 5.540 1.00 0.00 H new ATOM 0 HE21 GLN A 85 90.079 -9.484 4.007 1.00 0.00 H new ATOM 0 HE22 GLN A 85 89.314 -11.075 4.074 1.00 0.00 H new ATOM 1395 N ALA A 86 93.518 -7.218 5.310 1.00 0.00 N ATOM 1396 CA ALA A 86 94.465 -6.275 5.960 1.00 0.00 C ATOM 1397 C ALA A 86 95.523 -5.825 4.957 1.00 0.00 C ATOM 1398 O ALA A 86 96.136 -4.788 5.111 1.00 0.00 O ATOM 1399 CB ALA A 86 95.147 -6.992 7.122 1.00 0.00 C ATOM 0 H ALA A 86 93.570 -8.180 5.645 1.00 0.00 H new ATOM 0 HA ALA A 86 93.922 -5.401 6.320 1.00 0.00 H new ATOM 0 HB1 ALA A 86 95.846 -6.312 7.609 1.00 0.00 H new ATOM 0 HB2 ALA A 86 94.395 -7.316 7.841 1.00 0.00 H new ATOM 0 HB3 ALA A 86 95.688 -7.860 6.746 1.00 0.00 H new ATOM 1405 N ASP A 87 95.746 -6.596 3.934 1.00 0.00 N ATOM 1406 CA ASP A 87 96.767 -6.209 2.930 1.00 0.00 C ATOM 1407 C ASP A 87 96.178 -5.130 2.030 1.00 0.00 C ATOM 1408 O ASP A 87 96.871 -4.497 1.259 1.00 0.00 O ATOM 1409 CB ASP A 87 97.143 -7.431 2.092 1.00 0.00 C ATOM 1410 CG ASP A 87 95.873 -8.165 1.658 1.00 0.00 C ATOM 1411 OD1 ASP A 87 94.962 -7.504 1.187 1.00 0.00 O ATOM 1412 OD2 ASP A 87 95.833 -9.375 1.804 1.00 0.00 O ATOM 0 H ASP A 87 95.265 -7.477 3.750 1.00 0.00 H new ATOM 0 HA ASP A 87 97.660 -5.830 3.428 1.00 0.00 H new ATOM 0 HB2 ASP A 87 97.714 -7.122 1.216 1.00 0.00 H new ATOM 0 HB3 ASP A 87 97.782 -8.099 2.670 1.00 0.00 H new ATOM 1417 N ALA A 88 94.894 -4.919 2.130 1.00 0.00 N ATOM 1418 CA ALA A 88 94.228 -3.884 1.294 1.00 0.00 C ATOM 1419 C ALA A 88 94.023 -2.621 2.137 1.00 0.00 C ATOM 1420 O ALA A 88 93.258 -2.617 3.079 1.00 0.00 O ATOM 1421 CB ALA A 88 92.876 -4.450 0.836 1.00 0.00 C ATOM 0 H ALA A 88 94.273 -5.425 2.762 1.00 0.00 H new ATOM 0 HA ALA A 88 94.833 -3.628 0.425 1.00 0.00 H new ATOM 0 HB1 ALA A 88 92.363 -3.712 0.219 1.00 0.00 H new ATOM 0 HB2 ALA A 88 93.040 -5.358 0.255 1.00 0.00 H new ATOM 0 HB3 ALA A 88 92.265 -4.683 1.708 1.00 0.00 H new ATOM 1427 N LYS A 89 94.700 -1.547 1.810 1.00 0.00 N ATOM 1428 CA LYS A 89 94.538 -0.285 2.599 1.00 0.00 C ATOM 1429 C LYS A 89 93.541 0.630 1.898 1.00 0.00 C ATOM 1430 O LYS A 89 93.748 1.071 0.785 1.00 0.00 O ATOM 1431 CB LYS A 89 95.882 0.446 2.745 1.00 0.00 C ATOM 1432 CG LYS A 89 97.019 -0.548 3.003 1.00 0.00 C ATOM 1433 CD LYS A 89 96.934 -1.121 4.431 1.00 0.00 C ATOM 1434 CE LYS A 89 97.625 -2.482 4.477 1.00 0.00 C ATOM 1435 NZ LYS A 89 99.062 -2.327 4.114 1.00 0.00 N ATOM 0 H LYS A 89 95.357 -1.489 1.032 1.00 0.00 H new ATOM 0 HA LYS A 89 94.172 -0.545 3.592 1.00 0.00 H new ATOM 0 HB2 LYS A 89 96.091 1.017 1.840 1.00 0.00 H new ATOM 0 HB3 LYS A 89 95.825 1.161 3.566 1.00 0.00 H new ATOM 0 HG2 LYS A 89 96.969 -1.360 2.277 1.00 0.00 H new ATOM 0 HG3 LYS A 89 97.980 -0.053 2.862 1.00 0.00 H new ATOM 0 HD2 LYS A 89 97.406 -0.438 5.137 1.00 0.00 H new ATOM 0 HD3 LYS A 89 95.891 -1.221 4.733 1.00 0.00 H new ATOM 0 HE2 LYS A 89 97.536 -2.912 5.474 1.00 0.00 H new ATOM 0 HE3 LYS A 89 97.138 -3.172 3.788 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 99.577 -3.198 4.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 99.145 -2.148 3.093 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 99.469 -1.527 4.640 1.00 0.00 H new ATOM 1449 N LEU A 90 92.462 0.918 2.561 1.00 0.00 N ATOM 1450 CA LEU A 90 91.416 1.811 1.983 1.00 0.00 C ATOM 1451 C LEU A 90 91.662 3.239 2.462 1.00 0.00 C ATOM 1452 O LEU A 90 92.561 3.504 3.229 1.00 0.00 O ATOM 1453 CB LEU A 90 90.017 1.350 2.423 1.00 0.00 C ATOM 1454 CG LEU A 90 89.982 -0.171 2.524 1.00 0.00 C ATOM 1455 CD1 LEU A 90 88.562 -0.622 2.870 1.00 0.00 C ATOM 1456 CD2 LEU A 90 90.404 -0.792 1.189 1.00 0.00 C ATOM 0 H LEU A 90 92.253 0.568 3.496 1.00 0.00 H new ATOM 0 HA LEU A 90 91.469 1.770 0.895 1.00 0.00 H new ATOM 0 HB2 LEU A 90 89.764 1.793 3.386 1.00 0.00 H new ATOM 0 HB3 LEU A 90 89.269 1.693 1.708 1.00 0.00 H new ATOM 0 HG LEU A 90 90.672 -0.496 3.303 1.00 0.00 H new ATOM 0 HD11 LEU A 90 88.533 -1.709 2.943 1.00 0.00 H new ATOM 0 HD12 LEU A 90 88.264 -0.186 3.824 1.00 0.00 H new ATOM 0 HD13 LEU A 90 87.875 -0.292 2.090 1.00 0.00 H new ATOM 0 HD21 LEU A 90 90.377 -1.879 1.268 1.00 0.00 H new ATOM 0 HD22 LEU A 90 89.720 -0.468 0.405 1.00 0.00 H new ATOM 0 HD23 LEU A 90 91.416 -0.472 0.942 1.00 0.00 H new ATOM 1468 N GLN A 91 90.866 4.157 1.999 1.00 0.00 N ATOM 1469 CA GLN A 91 91.006 5.583 2.415 1.00 0.00 C ATOM 1470 C GLN A 91 89.614 6.090 2.774 1.00 0.00 C ATOM 1471 O GLN A 91 88.628 5.553 2.319 1.00 0.00 O ATOM 1472 CB GLN A 91 91.524 6.448 1.256 1.00 0.00 C ATOM 1473 CG GLN A 91 92.748 5.809 0.569 1.00 0.00 C ATOM 1474 CD GLN A 91 92.816 6.276 -0.881 1.00 0.00 C ATOM 1475 OE1 GLN A 91 93.564 5.740 -1.674 1.00 0.00 O ATOM 1476 NE2 GLN A 91 92.065 7.268 -1.253 1.00 0.00 N ATOM 0 H GLN A 91 90.110 3.979 1.338 1.00 0.00 H new ATOM 0 HA GLN A 91 91.706 5.646 3.248 1.00 0.00 H new ATOM 0 HB2 GLN A 91 90.729 6.590 0.524 1.00 0.00 H new ATOM 0 HB3 GLN A 91 91.792 7.436 1.631 1.00 0.00 H new ATOM 0 HG2 GLN A 91 93.661 6.087 1.095 1.00 0.00 H new ATOM 0 HG3 GLN A 91 92.675 4.722 0.610 1.00 0.00 H new ATOM 0 HE21 GLN A 91 91.439 7.713 -0.582 1.00 0.00 H new ATOM 0 HE22 GLN A 91 92.101 7.602 -2.216 1.00 0.00 H new ATOM 1485 N PHE A 92 89.518 7.134 3.550 1.00 0.00 N ATOM 1486 CA PHE A 92 88.177 7.691 3.899 1.00 0.00 C ATOM 1487 C PHE A 92 87.957 8.926 3.011 1.00 0.00 C ATOM 1488 O PHE A 92 88.619 9.930 3.125 1.00 0.00 O ATOM 1489 CB PHE A 92 88.159 7.987 5.424 1.00 0.00 C ATOM 1490 CG PHE A 92 87.454 9.288 5.785 1.00 0.00 C ATOM 1491 CD1 PHE A 92 88.089 10.520 5.582 1.00 0.00 C ATOM 1492 CD2 PHE A 92 86.174 9.255 6.353 1.00 0.00 C ATOM 1493 CE1 PHE A 92 87.448 11.711 5.942 1.00 0.00 C ATOM 1494 CE2 PHE A 92 85.533 10.448 6.713 1.00 0.00 C ATOM 1495 CZ PHE A 92 86.170 11.675 6.507 1.00 0.00 C ATOM 0 H PHE A 92 90.311 7.628 3.959 1.00 0.00 H new ATOM 0 HA PHE A 92 87.353 7.003 3.710 1.00 0.00 H new ATOM 0 HB2 PHE A 92 87.668 7.162 5.940 1.00 0.00 H new ATOM 0 HB3 PHE A 92 89.185 8.026 5.790 1.00 0.00 H new ATOM 0 HD1 PHE A 92 89.077 10.551 5.146 1.00 0.00 H new ATOM 0 HD2 PHE A 92 85.680 8.308 6.514 1.00 0.00 H new ATOM 0 HE1 PHE A 92 87.941 12.659 5.783 1.00 0.00 H new ATOM 0 HE2 PHE A 92 84.546 10.419 7.150 1.00 0.00 H new ATOM 0 HZ PHE A 92 85.675 12.594 6.784 1.00 0.00 H new ATOM 1505 N THR A 93 87.067 8.824 2.067 1.00 0.00 N ATOM 1506 CA THR A 93 86.839 9.969 1.133 1.00 0.00 C ATOM 1507 C THR A 93 85.487 9.793 0.429 1.00 0.00 C ATOM 1508 O THR A 93 84.967 8.700 0.348 1.00 0.00 O ATOM 1509 CB THR A 93 87.971 10.016 0.082 1.00 0.00 C ATOM 1510 OG1 THR A 93 87.433 10.348 -1.191 1.00 0.00 O ATOM 1511 CG2 THR A 93 88.665 8.652 -0.010 1.00 0.00 C ATOM 0 H THR A 93 86.487 8.002 1.898 1.00 0.00 H new ATOM 0 HA THR A 93 86.835 10.902 1.697 1.00 0.00 H new ATOM 0 HB THR A 93 88.696 10.772 0.385 1.00 0.00 H new ATOM 0 HG1 THR A 93 88.155 10.378 -1.853 1.00 0.00 H new ATOM 0 HG21 THR A 93 89.461 8.698 -0.754 1.00 0.00 H new ATOM 0 HG22 THR A 93 89.090 8.394 0.960 1.00 0.00 H new ATOM 0 HG23 THR A 93 87.939 7.893 -0.302 1.00 0.00 H new ATOM 1519 N PRO A 94 84.923 10.861 -0.084 1.00 0.00 N ATOM 1520 CA PRO A 94 83.611 10.812 -0.792 1.00 0.00 C ATOM 1521 C PRO A 94 83.559 9.668 -1.815 1.00 0.00 C ATOM 1522 O PRO A 94 82.513 9.050 -1.930 1.00 0.00 O ATOM 1523 CB PRO A 94 83.497 12.195 -1.488 1.00 0.00 C ATOM 1524 CG PRO A 94 84.827 12.873 -1.284 1.00 0.00 C ATOM 1525 CD PRO A 94 85.463 12.227 -0.056 1.00 0.00 C ATOM 0 HA PRO A 94 82.785 10.621 -0.107 1.00 0.00 H new ATOM 0 HB2 PRO A 94 83.276 12.081 -2.549 1.00 0.00 H new ATOM 0 HB3 PRO A 94 82.688 12.784 -1.056 1.00 0.00 H new ATOM 0 HG2 PRO A 94 85.463 12.749 -2.160 1.00 0.00 H new ATOM 0 HG3 PRO A 94 84.696 13.945 -1.134 1.00 0.00 H new ATOM 0 HD2 PRO A 94 86.551 12.232 -0.115 1.00 0.00 H new ATOM 0 HD3 PRO A 94 85.191 12.750 0.861 1.00 0.00 H new TER 1533 PRO A 94 ATOM 1534 N TYR B 541 51.271 34.708 12.169 1.00 0.00 N ATOM 1535 CA TYR B 541 51.222 36.126 12.625 1.00 0.00 C ATOM 1536 C TYR B 541 51.263 37.046 11.391 1.00 0.00 C ATOM 1537 O TYR B 541 50.944 36.637 10.292 1.00 0.00 O ATOM 1538 CB TYR B 541 52.430 36.395 13.563 1.00 0.00 C ATOM 1539 CG TYR B 541 51.952 36.799 14.949 1.00 0.00 C ATOM 1540 CD1 TYR B 541 51.275 38.012 15.127 1.00 0.00 C ATOM 1541 CD2 TYR B 541 52.184 35.961 16.049 1.00 0.00 C ATOM 1542 CE1 TYR B 541 50.831 38.388 16.401 1.00 0.00 C ATOM 1543 CE2 TYR B 541 51.740 36.338 17.323 1.00 0.00 C ATOM 1544 CZ TYR B 541 51.064 37.551 17.499 1.00 0.00 C ATOM 1545 OH TYR B 541 50.627 37.921 18.754 1.00 0.00 O ATOM 0 HA TYR B 541 50.303 36.324 13.177 1.00 0.00 H new ATOM 0 HB2 TYR B 541 53.050 35.501 13.632 1.00 0.00 H new ATOM 0 HB3 TYR B 541 53.054 37.184 13.144 1.00 0.00 H new ATOM 0 HD1 TYR B 541 51.095 38.658 14.281 1.00 0.00 H new ATOM 0 HD2 TYR B 541 52.705 35.025 15.914 1.00 0.00 H new ATOM 0 HE1 TYR B 541 50.309 39.324 16.536 1.00 0.00 H new ATOM 0 HE2 TYR B 541 51.919 35.692 18.170 1.00 0.00 H new ATOM 0 HH TYR B 541 50.869 37.227 19.402 1.00 0.00 H new ATOM 1555 N HIS B 542 51.643 38.282 11.567 1.00 0.00 N ATOM 1556 CA HIS B 542 51.694 39.220 10.416 1.00 0.00 C ATOM 1557 C HIS B 542 52.790 38.789 9.435 1.00 0.00 C ATOM 1558 O HIS B 542 52.668 37.789 8.756 1.00 0.00 O ATOM 1559 CB HIS B 542 51.994 40.623 10.940 1.00 0.00 C ATOM 1560 CG HIS B 542 50.827 41.112 11.752 1.00 0.00 C ATOM 1561 ND1 HIS B 542 49.785 40.277 12.123 1.00 0.00 N ATOM 1562 CD2 HIS B 542 50.524 42.345 12.274 1.00 0.00 C ATOM 1563 CE1 HIS B 542 48.911 41.011 12.836 1.00 0.00 C ATOM 1564 NE2 HIS B 542 49.313 42.280 12.957 1.00 0.00 N ATOM 0 H HIS B 542 51.921 38.682 12.463 1.00 0.00 H new ATOM 0 HA HIS B 542 50.737 39.213 9.895 1.00 0.00 H new ATOM 0 HB2 HIS B 542 52.897 40.610 11.551 1.00 0.00 H new ATOM 0 HB3 HIS B 542 52.182 41.302 10.108 1.00 0.00 H new ATOM 0 HD2 HIS B 542 51.133 43.231 12.170 1.00 0.00 H new ATOM 0 HE1 HIS B 542 47.996 40.622 13.259 1.00 0.00 H new ATOM 0 HE2 HIS B 542 48.835 43.038 13.445 1.00 0.00 H new ATOM 1572 N GLU B 543 53.855 39.543 9.349 1.00 0.00 N ATOM 1573 CA GLU B 543 54.959 39.187 8.405 1.00 0.00 C ATOM 1574 C GLU B 543 55.274 37.687 8.522 1.00 0.00 C ATOM 1575 O GLU B 543 55.774 37.076 7.600 1.00 0.00 O ATOM 1576 CB GLU B 543 56.222 40.036 8.717 1.00 0.00 C ATOM 1577 CG GLU B 543 56.067 40.741 10.071 1.00 0.00 C ATOM 1578 CD GLU B 543 57.397 41.382 10.469 1.00 0.00 C ATOM 1579 OE1 GLU B 543 57.805 41.196 11.603 1.00 0.00 O ATOM 1580 OE2 GLU B 543 57.985 42.049 9.633 1.00 0.00 O ATOM 0 H GLU B 543 54.009 40.392 9.893 1.00 0.00 H new ATOM 0 HA GLU B 543 54.644 39.402 7.384 1.00 0.00 H new ATOM 0 HB2 GLU B 543 57.104 39.396 8.731 1.00 0.00 H new ATOM 0 HB3 GLU B 543 56.376 40.774 7.930 1.00 0.00 H new ATOM 0 HG2 GLU B 543 55.289 41.502 10.010 1.00 0.00 H new ATOM 0 HG3 GLU B 543 55.754 40.026 10.832 1.00 0.00 H new ATOM 1587 N ARG B 544 54.979 37.093 9.644 1.00 0.00 N ATOM 1588 CA ARG B 544 55.252 35.638 9.814 1.00 0.00 C ATOM 1589 C ARG B 544 54.119 34.839 9.165 1.00 0.00 C ATOM 1590 O ARG B 544 52.971 34.958 9.545 1.00 0.00 O ATOM 1591 CB ARG B 544 55.334 35.300 11.308 1.00 0.00 C ATOM 1592 CG ARG B 544 56.608 35.920 11.923 1.00 0.00 C ATOM 1593 CD ARG B 544 56.372 37.392 12.323 1.00 0.00 C ATOM 1594 NE ARG B 544 56.324 37.496 13.808 1.00 0.00 N ATOM 1595 CZ ARG B 544 56.438 38.663 14.382 1.00 0.00 C ATOM 1596 NH1 ARG B 544 56.413 38.756 15.683 1.00 0.00 N ATOM 1597 NH2 ARG B 544 56.575 39.736 13.653 1.00 0.00 N ATOM 0 H ARG B 544 54.560 37.553 10.452 1.00 0.00 H new ATOM 0 HA ARG B 544 56.199 35.383 9.339 1.00 0.00 H new ATOM 0 HB2 ARG B 544 54.451 35.678 11.823 1.00 0.00 H new ATOM 0 HB3 ARG B 544 55.344 34.219 11.444 1.00 0.00 H new ATOM 0 HG2 ARG B 544 56.909 35.346 12.799 1.00 0.00 H new ATOM 0 HG3 ARG B 544 57.427 35.861 11.206 1.00 0.00 H new ATOM 0 HD2 ARG B 544 57.170 38.021 11.928 1.00 0.00 H new ATOM 0 HD3 ARG B 544 55.439 37.753 11.891 1.00 0.00 H new ATOM 0 HE ARG B 544 56.202 36.657 14.375 1.00 0.00 H new ATOM 0 HH11 ARG B 544 56.304 37.917 16.252 1.00 0.00 H new ATOM 0 HH12 ARG B 544 56.502 39.668 16.131 1.00 0.00 H new ATOM 0 HH21 ARG B 544 56.593 39.663 12.636 1.00 0.00 H new ATOM 0 HH22 ARG B 544 56.664 40.648 14.100 1.00 0.00 H new ATOM 1611 N ARG B 545 54.433 34.045 8.169 1.00 0.00 N ATOM 1612 CA ARG B 545 53.386 33.251 7.460 1.00 0.00 C ATOM 1613 C ARG B 545 53.849 31.793 7.308 1.00 0.00 C ATOM 1614 O ARG B 545 53.052 30.878 7.319 1.00 0.00 O ATOM 1615 CB ARG B 545 53.146 33.867 6.056 1.00 0.00 C ATOM 1616 CG ARG B 545 54.063 35.084 5.815 1.00 0.00 C ATOM 1617 CD ARG B 545 55.542 34.648 5.706 1.00 0.00 C ATOM 1618 NE ARG B 545 56.142 35.269 4.492 1.00 0.00 N ATOM 1619 CZ ARG B 545 57.438 35.290 4.340 1.00 0.00 C ATOM 1620 NH1 ARG B 545 57.961 35.841 3.279 1.00 0.00 N ATOM 1621 NH2 ARG B 545 58.211 34.760 5.248 1.00 0.00 N ATOM 0 H ARG B 545 55.381 33.914 7.815 1.00 0.00 H new ATOM 0 HA ARG B 545 52.461 33.272 8.037 1.00 0.00 H new ATOM 0 HB2 ARG B 545 53.329 33.114 5.290 1.00 0.00 H new ATOM 0 HB3 ARG B 545 52.103 34.170 5.963 1.00 0.00 H new ATOM 0 HG2 ARG B 545 53.762 35.595 4.901 1.00 0.00 H new ATOM 0 HG3 ARG B 545 53.949 35.797 6.631 1.00 0.00 H new ATOM 0 HD2 ARG B 545 56.091 34.954 6.596 1.00 0.00 H new ATOM 0 HD3 ARG B 545 55.611 33.562 5.647 1.00 0.00 H new ATOM 0 HE ARG B 545 55.539 35.678 3.778 1.00 0.00 H new ATOM 0 HH11 ARG B 545 57.357 36.255 2.569 1.00 0.00 H new ATOM 0 HH12 ARG B 545 58.974 35.858 3.160 1.00 0.00 H new ATOM 0 HH21 ARG B 545 57.802 34.329 6.077 1.00 0.00 H new ATOM 0 HH22 ARG B 545 59.224 34.777 5.128 1.00 0.00 H new ATOM 1635 N GLY B 546 55.122 31.585 7.134 1.00 0.00 N ATOM 1636 CA GLY B 546 55.647 30.197 6.946 1.00 0.00 C ATOM 1637 C GLY B 546 55.162 29.270 8.066 1.00 0.00 C ATOM 1638 O GLY B 546 53.999 28.931 8.153 1.00 0.00 O ATOM 0 H GLY B 546 55.830 32.319 7.113 1.00 0.00 H new ATOM 0 HA2 GLY B 546 55.321 29.809 5.981 1.00 0.00 H new ATOM 0 HA3 GLY B 546 56.737 30.215 6.931 1.00 0.00 H new ATOM 1642 N SER B 547 56.053 28.845 8.915 1.00 0.00 N ATOM 1643 CA SER B 547 55.662 27.929 10.021 1.00 0.00 C ATOM 1644 C SER B 547 56.805 27.901 11.026 1.00 0.00 C ATOM 1645 O SER B 547 57.905 27.529 10.701 1.00 0.00 O ATOM 1646 CB SER B 547 55.424 26.524 9.457 1.00 0.00 C ATOM 1647 OG SER B 547 54.061 26.398 9.075 1.00 0.00 O ATOM 0 H SER B 547 57.042 29.094 8.890 1.00 0.00 H new ATOM 0 HA SER B 547 54.746 28.270 10.502 1.00 0.00 H new ATOM 0 HB2 SER B 547 56.072 26.349 8.598 1.00 0.00 H new ATOM 0 HB3 SER B 547 55.676 25.772 10.205 1.00 0.00 H new ATOM 0 HG SER B 547 53.757 27.235 8.666 1.00 0.00 H new ATOM 1653 N LEU B 548 56.570 28.311 12.232 1.00 0.00 N ATOM 1654 CA LEU B 548 57.672 28.324 13.225 1.00 0.00 C ATOM 1655 C LEU B 548 58.227 26.917 13.423 1.00 0.00 C ATOM 1656 O LEU B 548 57.491 25.972 13.587 1.00 0.00 O ATOM 1657 CB LEU B 548 57.143 28.882 14.566 1.00 0.00 C ATOM 1658 CG LEU B 548 57.527 30.367 14.710 1.00 0.00 C ATOM 1659 CD1 LEU B 548 56.725 31.213 13.719 1.00 0.00 C ATOM 1660 CD2 LEU B 548 57.241 30.849 16.130 1.00 0.00 C ATOM 0 H LEU B 548 55.666 28.637 12.575 1.00 0.00 H new ATOM 0 HA LEU B 548 58.477 28.961 12.859 1.00 0.00 H new ATOM 0 HB2 LEU B 548 56.060 28.772 14.612 1.00 0.00 H new ATOM 0 HB3 LEU B 548 57.557 28.309 15.396 1.00 0.00 H new ATOM 0 HG LEU B 548 58.591 30.473 14.501 1.00 0.00 H new ATOM 0 HD11 LEU B 548 57.003 32.261 13.828 1.00 0.00 H new ATOM 0 HD12 LEU B 548 56.940 30.884 12.702 1.00 0.00 H new ATOM 0 HD13 LEU B 548 55.660 31.097 13.920 1.00 0.00 H new ATOM 0 HD21 LEU B 548 57.516 31.900 16.220 1.00 0.00 H new ATOM 0 HD22 LEU B 548 56.179 30.732 16.347 1.00 0.00 H new ATOM 0 HD23 LEU B 548 57.823 30.260 16.838 1.00 0.00 H new ATOM 1672 N CYS B 549 59.531 26.784 13.456 1.00 0.00 N ATOM 1673 CA CYS B 549 60.127 25.446 13.686 1.00 0.00 C ATOM 1674 C CYS B 549 60.131 25.251 15.192 1.00 0.00 C ATOM 1675 O CYS B 549 60.913 25.837 15.912 1.00 0.00 O ATOM 1676 CB CYS B 549 61.565 25.444 13.136 1.00 0.00 C ATOM 1677 SG CYS B 549 62.588 24.174 13.946 1.00 0.00 S ATOM 0 H CYS B 549 60.199 27.545 13.333 1.00 0.00 H new ATOM 0 HA CYS B 549 59.575 24.648 13.191 1.00 0.00 H new ATOM 0 HB2 CYS B 549 61.544 25.265 12.061 1.00 0.00 H new ATOM 0 HB3 CYS B 549 62.015 26.425 13.287 1.00 0.00 H new ATOM 1682 N SER B 550 59.222 24.457 15.671 1.00 0.00 N ATOM 1683 CA SER B 550 59.117 24.247 17.136 1.00 0.00 C ATOM 1684 C SER B 550 60.474 23.877 17.698 1.00 0.00 C ATOM 1685 O SER B 550 61.156 22.994 17.217 1.00 0.00 O ATOM 1686 CB SER B 550 58.074 23.179 17.450 1.00 0.00 C ATOM 1687 OG SER B 550 58.182 22.805 18.818 1.00 0.00 O ATOM 0 H SER B 550 58.544 23.942 15.109 1.00 0.00 H new ATOM 0 HA SER B 550 58.791 25.173 17.609 1.00 0.00 H new ATOM 0 HB2 SER B 550 57.074 23.559 17.243 1.00 0.00 H new ATOM 0 HB3 SER B 550 58.223 22.309 16.810 1.00 0.00 H new ATOM 0 HG SER B 550 57.297 22.839 19.237 1.00 0.00 H new ATOM 1693 N GLY B 551 60.881 24.602 18.696 1.00 0.00 N ATOM 1694 CA GLY B 551 62.219 24.391 19.315 1.00 0.00 C ATOM 1695 C GLY B 551 63.058 25.593 18.929 1.00 0.00 C ATOM 1696 O GLY B 551 63.870 26.088 19.685 1.00 0.00 O ATOM 0 H GLY B 551 60.332 25.350 19.120 1.00 0.00 H new ATOM 0 HA2 GLY B 551 62.137 24.305 20.399 1.00 0.00 H new ATOM 0 HA3 GLY B 551 62.673 23.468 18.955 1.00 0.00 H new ATOM 1700 N CYS B 552 62.823 26.079 17.745 1.00 0.00 N ATOM 1701 CA CYS B 552 63.536 27.273 17.245 1.00 0.00 C ATOM 1702 C CYS B 552 62.557 28.440 17.296 1.00 0.00 C ATOM 1703 O CYS B 552 62.913 29.570 17.559 1.00 0.00 O ATOM 1704 CB CYS B 552 63.918 27.022 15.789 1.00 0.00 C ATOM 1705 SG CYS B 552 65.463 26.088 15.697 1.00 0.00 S ATOM 0 H CYS B 552 62.148 25.685 17.090 1.00 0.00 H new ATOM 0 HA CYS B 552 64.426 27.483 17.838 1.00 0.00 H new ATOM 0 HB2 CYS B 552 63.122 26.472 15.287 1.00 0.00 H new ATOM 0 HB3 CYS B 552 64.028 27.972 15.266 1.00 0.00 H new ATOM 1710 N GLN B 553 61.320 28.149 17.021 1.00 0.00 N ATOM 1711 CA GLN B 553 60.272 29.192 17.005 1.00 0.00 C ATOM 1712 C GLN B 553 60.657 30.302 16.047 1.00 0.00 C ATOM 1713 O GLN B 553 60.705 31.468 16.380 1.00 0.00 O ATOM 1714 CB GLN B 553 60.015 29.726 18.400 1.00 0.00 C ATOM 1715 CG GLN B 553 59.428 28.597 19.245 1.00 0.00 C ATOM 1716 CD GLN B 553 58.031 28.213 18.748 1.00 0.00 C ATOM 1717 OE1 GLN B 553 57.035 28.683 19.261 1.00 0.00 O ATOM 1718 NE2 GLN B 553 57.927 27.369 17.759 1.00 0.00 N ATOM 0 H GLN B 553 60.988 27.210 16.802 1.00 0.00 H new ATOM 0 HA GLN B 553 59.341 28.747 16.654 1.00 0.00 H new ATOM 0 HB2 GLN B 553 60.942 30.090 18.844 1.00 0.00 H new ATOM 0 HB3 GLN B 553 59.326 30.570 18.363 1.00 0.00 H new ATOM 0 HG2 GLN B 553 60.085 27.728 19.205 1.00 0.00 H new ATOM 0 HG3 GLN B 553 59.375 28.908 20.288 1.00 0.00 H new ATOM 0 HE21 GLN B 553 58.767 26.978 17.332 1.00 0.00 H new ATOM 0 HE22 GLN B 553 57.006 27.100 17.412 1.00 0.00 H new ATOM 1727 N LYS B 554 60.886 29.907 14.836 1.00 0.00 N ATOM 1728 CA LYS B 554 61.234 30.859 13.736 1.00 0.00 C ATOM 1729 C LYS B 554 60.499 30.377 12.465 1.00 0.00 C ATOM 1730 O LYS B 554 60.661 29.236 12.080 1.00 0.00 O ATOM 1731 CB LYS B 554 62.743 30.834 13.470 1.00 0.00 C ATOM 1732 CG LYS B 554 63.514 31.294 14.712 1.00 0.00 C ATOM 1733 CD LYS B 554 63.259 32.786 14.979 1.00 0.00 C ATOM 1734 CE LYS B 554 64.402 33.365 15.820 1.00 0.00 C ATOM 1735 NZ LYS B 554 65.686 33.221 15.076 1.00 0.00 N ATOM 0 H LYS B 554 60.847 28.930 14.544 1.00 0.00 H new ATOM 0 HA LYS B 554 60.943 31.873 14.010 1.00 0.00 H new ATOM 0 HB2 LYS B 554 63.053 29.826 13.195 1.00 0.00 H new ATOM 0 HB3 LYS B 554 62.980 31.482 12.626 1.00 0.00 H new ATOM 0 HG2 LYS B 554 63.207 30.706 15.577 1.00 0.00 H new ATOM 0 HG3 LYS B 554 64.581 31.120 14.571 1.00 0.00 H new ATOM 0 HD2 LYS B 554 63.180 33.326 14.035 1.00 0.00 H new ATOM 0 HD3 LYS B 554 62.310 32.915 15.500 1.00 0.00 H new ATOM 0 HE2 LYS B 554 64.211 34.416 16.039 1.00 0.00 H new ATOM 0 HE3 LYS B 554 64.463 32.846 16.777 1.00 0.00 H new ATOM 0 HZ1 LYS B 554 66.296 34.040 15.274 1.00 0.00 H new ATOM 0 HZ2 LYS B 554 66.167 32.350 15.379 1.00 0.00 H new ATOM 0 HZ3 LYS B 554 65.492 33.172 14.055 1.00 0.00 H new ATOM 1749 N PRO B 555 59.680 31.184 11.818 1.00 0.00 N ATOM 1750 CA PRO B 555 58.942 30.712 10.609 1.00 0.00 C ATOM 1751 C PRO B 555 59.784 29.908 9.619 1.00 0.00 C ATOM 1752 O PRO B 555 60.892 30.263 9.267 1.00 0.00 O ATOM 1753 CB PRO B 555 58.466 32.024 9.987 1.00 0.00 C ATOM 1754 CG PRO B 555 58.454 33.076 11.108 1.00 0.00 C ATOM 1755 CD PRO B 555 59.405 32.591 12.223 1.00 0.00 C ATOM 0 HA PRO B 555 58.150 30.012 10.874 1.00 0.00 H new ATOM 0 HB2 PRO B 555 59.130 32.330 9.178 1.00 0.00 H new ATOM 0 HB3 PRO B 555 57.471 31.908 9.557 1.00 0.00 H new ATOM 0 HG2 PRO B 555 58.776 34.045 10.726 1.00 0.00 H new ATOM 0 HG3 PRO B 555 57.444 33.207 11.498 1.00 0.00 H new ATOM 0 HD2 PRO B 555 60.317 33.187 12.267 1.00 0.00 H new ATOM 0 HD3 PRO B 555 58.940 32.647 13.207 1.00 0.00 H new ATOM 1763 N ILE B 556 59.223 28.826 9.164 1.00 0.00 N ATOM 1764 CA ILE B 556 59.901 27.949 8.179 1.00 0.00 C ATOM 1765 C ILE B 556 59.439 28.370 6.781 1.00 0.00 C ATOM 1766 O ILE B 556 58.366 28.009 6.341 1.00 0.00 O ATOM 1767 CB ILE B 556 59.472 26.508 8.457 1.00 0.00 C ATOM 1768 CG1 ILE B 556 60.048 26.035 9.813 1.00 0.00 C ATOM 1769 CG2 ILE B 556 59.984 25.602 7.344 1.00 0.00 C ATOM 1770 CD1 ILE B 556 59.191 24.891 10.396 1.00 0.00 C ATOM 0 H ILE B 556 58.296 28.506 9.444 1.00 0.00 H new ATOM 0 HA ILE B 556 60.986 28.028 8.249 1.00 0.00 H new ATOM 0 HB ILE B 556 58.384 26.462 8.497 1.00 0.00 H new ATOM 0 HG12 ILE B 556 61.075 25.696 9.680 1.00 0.00 H new ATOM 0 HG13 ILE B 556 60.076 26.869 10.514 1.00 0.00 H new ATOM 0 HG21 ILE B 556 59.678 24.575 7.542 1.00 0.00 H new ATOM 0 HG22 ILE B 556 59.568 25.927 6.390 1.00 0.00 H new ATOM 0 HG23 ILE B 556 61.072 25.655 7.303 1.00 0.00 H new ATOM 0 HD11 ILE B 556 59.611 24.571 11.350 1.00 0.00 H new ATOM 0 HD12 ILE B 556 58.171 25.242 10.549 1.00 0.00 H new ATOM 0 HD13 ILE B 556 59.185 24.051 9.702 1.00 0.00 H new ATOM 1782 N THR B 557 60.222 29.163 6.094 1.00 0.00 N ATOM 1783 CA THR B 557 59.809 29.650 4.737 1.00 0.00 C ATOM 1784 C THR B 557 60.480 28.838 3.629 1.00 0.00 C ATOM 1785 O THR B 557 61.559 29.152 3.167 1.00 0.00 O ATOM 1786 CB THR B 557 60.197 31.119 4.616 1.00 0.00 C ATOM 1787 OG1 THR B 557 61.584 31.223 4.323 1.00 0.00 O ATOM 1788 CG2 THR B 557 59.895 31.812 5.943 1.00 0.00 C ATOM 0 H THR B 557 61.132 29.496 6.413 1.00 0.00 H new ATOM 0 HA THR B 557 58.731 29.530 4.625 1.00 0.00 H new ATOM 0 HB THR B 557 59.631 31.591 3.813 1.00 0.00 H new ATOM 0 HG1 THR B 557 61.778 30.752 3.486 1.00 0.00 H new ATOM 0 HG21 THR B 557 60.167 32.865 5.874 1.00 0.00 H new ATOM 0 HG22 THR B 557 58.831 31.726 6.165 1.00 0.00 H new ATOM 0 HG23 THR B 557 60.471 31.340 6.739 1.00 0.00 H new ATOM 1796 N GLY B 558 59.826 27.800 3.201 1.00 0.00 N ATOM 1797 CA GLY B 558 60.367 26.936 2.117 1.00 0.00 C ATOM 1798 C GLY B 558 59.733 25.560 2.266 1.00 0.00 C ATOM 1799 O GLY B 558 58.626 25.319 1.828 1.00 0.00 O ATOM 0 H GLY B 558 58.919 27.506 3.564 1.00 0.00 H new ATOM 0 HA2 GLY B 558 60.138 27.360 1.139 1.00 0.00 H new ATOM 0 HA3 GLY B 558 61.453 26.867 2.188 1.00 0.00 H new ATOM 1803 N ARG B 559 60.420 24.671 2.920 1.00 0.00 N ATOM 1804 CA ARG B 559 59.886 23.305 3.167 1.00 0.00 C ATOM 1805 C ARG B 559 59.644 23.186 4.663 1.00 0.00 C ATOM 1806 O ARG B 559 60.307 23.830 5.449 1.00 0.00 O ATOM 1807 CB ARG B 559 60.932 22.268 2.721 1.00 0.00 C ATOM 1808 CG ARG B 559 60.747 21.943 1.231 1.00 0.00 C ATOM 1809 CD ARG B 559 59.702 20.834 1.062 1.00 0.00 C ATOM 1810 NE ARG B 559 59.259 20.778 -0.360 1.00 0.00 N ATOM 1811 CZ ARG B 559 58.605 19.738 -0.799 1.00 0.00 C ATOM 1812 NH1 ARG B 559 58.224 19.682 -2.046 1.00 0.00 N ATOM 1813 NH2 ARG B 559 58.330 18.753 0.011 1.00 0.00 N ATOM 0 H ARG B 559 61.351 24.837 3.303 1.00 0.00 H new ATOM 0 HA ARG B 559 58.964 23.131 2.613 1.00 0.00 H new ATOM 0 HB2 ARG B 559 61.936 22.654 2.896 1.00 0.00 H new ATOM 0 HB3 ARG B 559 60.832 21.360 3.315 1.00 0.00 H new ATOM 0 HG2 ARG B 559 60.432 22.836 0.692 1.00 0.00 H new ATOM 0 HG3 ARG B 559 61.697 21.628 0.798 1.00 0.00 H new ATOM 0 HD2 ARG B 559 60.124 19.874 1.360 1.00 0.00 H new ATOM 0 HD3 ARG B 559 58.848 21.023 1.712 1.00 0.00 H new ATOM 0 HE ARG B 559 59.467 21.553 -0.990 1.00 0.00 H new ATOM 0 HH11 ARG B 559 58.437 20.452 -2.680 1.00 0.00 H new ATOM 0 HH12 ARG B 559 57.713 18.868 -2.387 1.00 0.00 H new ATOM 0 HH21 ARG B 559 58.626 18.797 0.986 1.00 0.00 H new ATOM 0 HH22 ARG B 559 57.819 17.939 -0.331 1.00 0.00 H new ATOM 1827 N CYS B 560 58.704 22.384 5.078 1.00 0.00 N ATOM 1828 CA CYS B 560 58.452 22.257 6.543 1.00 0.00 C ATOM 1829 C CYS B 560 58.053 20.843 6.916 1.00 0.00 C ATOM 1830 O CYS B 560 57.117 20.275 6.390 1.00 0.00 O ATOM 1831 CB CYS B 560 57.355 23.228 6.976 1.00 0.00 C ATOM 1832 SG CYS B 560 55.864 22.938 5.992 1.00 0.00 S ATOM 0 H CYS B 560 58.106 21.817 4.477 1.00 0.00 H new ATOM 0 HA CYS B 560 59.380 22.499 7.060 1.00 0.00 H new ATOM 0 HB2 CYS B 560 57.135 23.095 8.035 1.00 0.00 H new ATOM 0 HB3 CYS B 560 57.694 24.256 6.847 1.00 0.00 H new ATOM 0 HG CYS B 560 55.755 21.669 5.733 1.00 0.00 H new ATOM 1838 N ILE B 561 58.759 20.289 7.856 1.00 0.00 N ATOM 1839 CA ILE B 561 58.452 18.927 8.333 1.00 0.00 C ATOM 1840 C ILE B 561 57.488 19.050 9.485 1.00 0.00 C ATOM 1841 O ILE B 561 57.536 19.987 10.253 1.00 0.00 O ATOM 1842 CB ILE B 561 59.739 18.274 8.813 1.00 0.00 C ATOM 1843 CG1 ILE B 561 60.648 18.142 7.606 1.00 0.00 C ATOM 1844 CG2 ILE B 561 59.462 16.885 9.409 1.00 0.00 C ATOM 1845 CD1 ILE B 561 61.927 17.418 8.001 1.00 0.00 C ATOM 0 H ILE B 561 59.550 20.735 8.320 1.00 0.00 H new ATOM 0 HA ILE B 561 58.016 18.322 7.538 1.00 0.00 H new ATOM 0 HB ILE B 561 60.200 18.880 9.593 1.00 0.00 H new ATOM 0 HG12 ILE B 561 60.139 17.593 6.814 1.00 0.00 H new ATOM 0 HG13 ILE B 561 60.886 19.129 7.209 1.00 0.00 H new ATOM 0 HG21 ILE B 561 60.399 16.440 9.745 1.00 0.00 H new ATOM 0 HG22 ILE B 561 58.782 16.981 10.256 1.00 0.00 H new ATOM 0 HG23 ILE B 561 59.009 16.247 8.650 1.00 0.00 H new ATOM 0 HD11 ILE B 561 62.577 17.326 7.131 1.00 0.00 H new ATOM 0 HD12 ILE B 561 62.440 17.984 8.778 1.00 0.00 H new ATOM 0 HD13 ILE B 561 61.682 16.425 8.377 1.00 0.00 H new ATOM 1857 N THR B 562 56.620 18.099 9.605 1.00 0.00 N ATOM 1858 CA THR B 562 55.619 18.111 10.712 1.00 0.00 C ATOM 1859 C THR B 562 55.829 16.892 11.585 1.00 0.00 C ATOM 1860 O THR B 562 56.236 15.840 11.131 1.00 0.00 O ATOM 1861 CB THR B 562 54.191 18.105 10.168 1.00 0.00 C ATOM 1862 OG1 THR B 562 54.080 19.046 9.109 1.00 0.00 O ATOM 1863 CG2 THR B 562 53.226 18.481 11.299 1.00 0.00 C ATOM 0 H THR B 562 56.554 17.298 8.977 1.00 0.00 H new ATOM 0 HA THR B 562 55.759 19.022 11.293 1.00 0.00 H new ATOM 0 HB THR B 562 53.944 17.113 9.789 1.00 0.00 H new ATOM 0 HG1 THR B 562 53.164 19.040 8.760 1.00 0.00 H new ATOM 0 HG21 THR B 562 52.204 18.480 10.921 1.00 0.00 H new ATOM 0 HG22 THR B 562 53.314 17.757 12.109 1.00 0.00 H new ATOM 0 HG23 THR B 562 53.473 19.475 11.673 1.00 0.00 H new ATOM 1871 N ALA B 563 55.575 17.049 12.845 1.00 0.00 N ATOM 1872 CA ALA B 563 55.764 15.948 13.819 1.00 0.00 C ATOM 1873 C ALA B 563 54.455 15.694 14.558 1.00 0.00 C ATOM 1874 O ALA B 563 53.408 15.533 13.962 1.00 0.00 O ATOM 1875 CB ALA B 563 56.850 16.363 14.798 1.00 0.00 C ATOM 0 H ALA B 563 55.234 17.919 13.253 1.00 0.00 H new ATOM 0 HA ALA B 563 56.058 15.030 13.309 1.00 0.00 H new ATOM 0 HB1 ALA B 563 57.007 15.567 15.526 1.00 0.00 H new ATOM 0 HB2 ALA B 563 57.778 16.547 14.256 1.00 0.00 H new ATOM 0 HB3 ALA B 563 56.545 17.273 15.315 1.00 0.00 H new ATOM 1881 N MET B 564 54.514 15.661 15.854 1.00 0.00 N ATOM 1882 CA MET B 564 53.296 15.426 16.678 1.00 0.00 C ATOM 1883 C MET B 564 52.340 16.603 16.505 1.00 0.00 C ATOM 1884 O MET B 564 51.568 16.917 17.387 1.00 0.00 O ATOM 1885 CB MET B 564 53.717 15.333 18.140 1.00 0.00 C ATOM 1886 CG MET B 564 55.063 14.612 18.240 1.00 0.00 C ATOM 1887 SD MET B 564 55.340 14.081 19.949 1.00 0.00 S ATOM 1888 CE MET B 564 54.644 12.419 19.791 1.00 0.00 C ATOM 0 H MET B 564 55.371 15.789 16.391 1.00 0.00 H new ATOM 0 HA MET B 564 52.800 14.506 16.368 1.00 0.00 H new ATOM 0 HB2 MET B 564 53.794 16.331 18.571 1.00 0.00 H new ATOM 0 HB3 MET B 564 52.961 14.796 18.713 1.00 0.00 H new ATOM 0 HG2 MET B 564 55.076 13.749 17.574 1.00 0.00 H new ATOM 0 HG3 MET B 564 55.867 15.274 17.919 1.00 0.00 H new ATOM 0 HE1 MET B 564 54.714 11.903 20.749 1.00 0.00 H new ATOM 0 HE2 MET B 564 53.598 12.489 19.492 1.00 0.00 H new ATOM 0 HE3 MET B 564 55.200 11.862 19.037 1.00 0.00 H new ATOM 1898 N ALA B 565 52.454 17.250 15.382 1.00 0.00 N ATOM 1899 CA ALA B 565 51.652 18.458 15.020 1.00 0.00 C ATOM 1900 C ALA B 565 52.604 19.638 15.057 1.00 0.00 C ATOM 1901 O ALA B 565 52.285 20.732 14.636 1.00 0.00 O ATOM 1902 CB ALA B 565 50.483 18.720 15.972 1.00 0.00 C ATOM 0 H ALA B 565 53.112 16.973 14.654 1.00 0.00 H new ATOM 0 HA ALA B 565 51.209 18.302 14.036 1.00 0.00 H new ATOM 0 HB1 ALA B 565 49.944 19.611 15.650 1.00 0.00 H new ATOM 0 HB2 ALA B 565 49.808 17.865 15.963 1.00 0.00 H new ATOM 0 HB3 ALA B 565 50.863 18.871 16.982 1.00 0.00 H new ATOM 1908 N LYS B 566 53.793 19.410 15.548 1.00 0.00 N ATOM 1909 CA LYS B 566 54.795 20.503 15.602 1.00 0.00 C ATOM 1910 C LYS B 566 55.448 20.612 14.231 1.00 0.00 C ATOM 1911 O LYS B 566 55.380 19.703 13.438 1.00 0.00 O ATOM 1912 CB LYS B 566 55.865 20.160 16.649 1.00 0.00 C ATOM 1913 CG LYS B 566 55.510 20.790 17.999 1.00 0.00 C ATOM 1914 CD LYS B 566 56.326 20.113 19.113 1.00 0.00 C ATOM 1915 CE LYS B 566 55.578 18.872 19.629 1.00 0.00 C ATOM 1916 NZ LYS B 566 56.553 17.921 20.233 1.00 0.00 N ATOM 0 H LYS B 566 54.110 18.512 15.913 1.00 0.00 H new ATOM 0 HA LYS B 566 54.318 21.445 15.873 1.00 0.00 H new ATOM 0 HB2 LYS B 566 55.946 19.078 16.755 1.00 0.00 H new ATOM 0 HB3 LYS B 566 56.838 20.521 16.316 1.00 0.00 H new ATOM 0 HG2 LYS B 566 55.719 21.860 17.979 1.00 0.00 H new ATOM 0 HG3 LYS B 566 54.444 20.678 18.195 1.00 0.00 H new ATOM 0 HD2 LYS B 566 57.307 19.826 18.734 1.00 0.00 H new ATOM 0 HD3 LYS B 566 56.493 20.814 19.931 1.00 0.00 H new ATOM 0 HE2 LYS B 566 54.833 19.165 20.369 1.00 0.00 H new ATOM 0 HE3 LYS B 566 55.043 18.390 18.811 1.00 0.00 H new ATOM 0 HZ1 LYS B 566 56.048 17.081 20.582 1.00 0.00 H new ATOM 0 HZ2 LYS B 566 57.248 17.633 19.515 1.00 0.00 H new ATOM 0 HZ3 LYS B 566 57.044 18.384 21.024 1.00 0.00 H new ATOM 1930 N LYS B 567 56.095 21.712 13.959 1.00 0.00 N ATOM 1931 CA LYS B 567 56.778 21.893 12.649 1.00 0.00 C ATOM 1932 C LYS B 567 58.274 21.730 12.888 1.00 0.00 C ATOM 1933 O LYS B 567 58.706 21.575 14.013 1.00 0.00 O ATOM 1934 CB LYS B 567 56.461 23.286 12.103 1.00 0.00 C ATOM 1935 CG LYS B 567 55.008 23.663 12.445 1.00 0.00 C ATOM 1936 CD LYS B 567 54.016 22.649 11.840 1.00 0.00 C ATOM 1937 CE LYS B 567 54.108 22.679 10.314 1.00 0.00 C ATOM 1938 NZ LYS B 567 52.866 22.096 9.731 1.00 0.00 N ATOM 0 H LYS B 567 56.180 22.503 14.598 1.00 0.00 H new ATOM 0 HA LYS B 567 56.439 21.159 11.918 1.00 0.00 H new ATOM 0 HB2 LYS B 567 57.146 24.018 12.530 1.00 0.00 H new ATOM 0 HB3 LYS B 567 56.607 23.305 11.023 1.00 0.00 H new ATOM 0 HG2 LYS B 567 54.883 23.698 13.527 1.00 0.00 H new ATOM 0 HG3 LYS B 567 54.789 24.661 12.066 1.00 0.00 H new ATOM 0 HD2 LYS B 567 54.238 21.647 12.207 1.00 0.00 H new ATOM 0 HD3 LYS B 567 53.001 22.887 12.157 1.00 0.00 H new ATOM 0 HE2 LYS B 567 54.239 23.704 9.967 1.00 0.00 H new ATOM 0 HE3 LYS B 567 54.979 22.115 9.980 1.00 0.00 H new ATOM 0 HZ1 LYS B 567 52.617 22.608 8.861 1.00 0.00 H new ATOM 0 HZ2 LYS B 567 53.025 21.093 9.508 1.00 0.00 H new ATOM 0 HZ3 LYS B 567 52.088 22.180 10.416 1.00 0.00 H new ATOM 1952 N PHE B 568 59.082 21.739 11.867 1.00 0.00 N ATOM 1953 CA PHE B 568 60.539 21.554 12.120 1.00 0.00 C ATOM 1954 C PHE B 568 61.346 22.065 10.940 1.00 0.00 C ATOM 1955 O PHE B 568 61.074 21.740 9.802 1.00 0.00 O ATOM 1956 CB PHE B 568 60.827 20.040 12.323 1.00 0.00 C ATOM 1957 CG PHE B 568 61.060 19.737 13.791 1.00 0.00 C ATOM 1958 CD1 PHE B 568 62.306 20.002 14.371 1.00 0.00 C ATOM 1959 CD2 PHE B 568 60.027 19.197 14.568 1.00 0.00 C ATOM 1960 CE1 PHE B 568 62.520 19.726 15.727 1.00 0.00 C ATOM 1961 CE2 PHE B 568 60.242 18.921 15.923 1.00 0.00 C ATOM 1962 CZ PHE B 568 61.488 19.185 16.503 1.00 0.00 C ATOM 0 H PHE B 568 58.809 21.863 10.892 1.00 0.00 H new ATOM 0 HA PHE B 568 60.824 22.114 13.011 1.00 0.00 H new ATOM 0 HB2 PHE B 568 59.988 19.451 11.953 1.00 0.00 H new ATOM 0 HB3 PHE B 568 61.702 19.749 11.742 1.00 0.00 H new ATOM 0 HD1 PHE B 568 63.102 20.419 13.773 1.00 0.00 H new ATOM 0 HD2 PHE B 568 59.065 18.994 14.121 1.00 0.00 H new ATOM 0 HE1 PHE B 568 63.481 19.931 16.174 1.00 0.00 H new ATOM 0 HE2 PHE B 568 59.446 18.504 16.522 1.00 0.00 H new ATOM 0 HZ PHE B 568 61.653 18.971 17.549 1.00 0.00 H new ATOM 1972 N HIS B 569 62.378 22.814 11.207 1.00 0.00 N ATOM 1973 CA HIS B 569 63.239 23.284 10.097 1.00 0.00 C ATOM 1974 C HIS B 569 63.657 22.020 9.328 1.00 0.00 C ATOM 1975 O HIS B 569 64.346 21.188 9.884 1.00 0.00 O ATOM 1976 CB HIS B 569 64.498 23.943 10.672 1.00 0.00 C ATOM 1977 CG HIS B 569 64.265 25.395 10.967 1.00 0.00 C ATOM 1978 ND1 HIS B 569 64.401 25.901 12.246 1.00 0.00 N ATOM 1979 CD2 HIS B 569 63.966 26.465 10.164 1.00 0.00 C ATOM 1980 CE1 HIS B 569 64.197 27.227 12.179 1.00 0.00 C ATOM 1981 NE2 HIS B 569 63.924 27.624 10.932 1.00 0.00 N ATOM 0 H HIS B 569 62.658 23.117 12.140 1.00 0.00 H new ATOM 0 HA HIS B 569 62.720 24.004 9.464 1.00 0.00 H new ATOM 0 HB2 HIS B 569 64.797 23.427 11.585 1.00 0.00 H new ATOM 0 HB3 HIS B 569 65.321 23.841 9.964 1.00 0.00 H new ATOM 0 HD2 HIS B 569 63.790 26.416 9.100 1.00 0.00 H new ATOM 0 HE1 HIS B 569 64.247 27.891 13.029 1.00 0.00 H new ATOM 0 HE2 HIS B 569 63.727 28.572 10.613 1.00 0.00 H new ATOM 1988 N PRO B 570 63.250 21.828 8.099 1.00 0.00 N ATOM 1989 CA PRO B 570 63.640 20.591 7.384 1.00 0.00 C ATOM 1990 C PRO B 570 65.139 20.305 7.546 1.00 0.00 C ATOM 1991 O PRO B 570 65.620 19.239 7.224 1.00 0.00 O ATOM 1992 CB PRO B 570 63.260 20.932 5.937 1.00 0.00 C ATOM 1993 CG PRO B 570 62.212 22.052 6.002 1.00 0.00 C ATOM 1994 CD PRO B 570 62.405 22.786 7.335 1.00 0.00 C ATOM 0 HA PRO B 570 63.156 19.686 7.752 1.00 0.00 H new ATOM 0 HB2 PRO B 570 64.136 21.255 5.374 1.00 0.00 H new ATOM 0 HB3 PRO B 570 62.858 20.057 5.427 1.00 0.00 H new ATOM 0 HG2 PRO B 570 62.333 22.739 5.165 1.00 0.00 H new ATOM 0 HG3 PRO B 570 61.205 21.640 5.933 1.00 0.00 H new ATOM 0 HD2 PRO B 570 62.898 23.749 7.202 1.00 0.00 H new ATOM 0 HD3 PRO B 570 61.456 22.980 7.834 1.00 0.00 H new ATOM 2002 N GLU B 571 65.876 21.261 8.058 1.00 0.00 N ATOM 2003 CA GLU B 571 67.342 21.076 8.253 1.00 0.00 C ATOM 2004 C GLU B 571 67.631 20.618 9.686 1.00 0.00 C ATOM 2005 O GLU B 571 68.320 19.651 9.925 1.00 0.00 O ATOM 2006 CB GLU B 571 68.039 22.419 8.016 1.00 0.00 C ATOM 2007 CG GLU B 571 67.340 23.143 6.873 1.00 0.00 C ATOM 2008 CD GLU B 571 68.183 24.338 6.426 1.00 0.00 C ATOM 2009 OE1 GLU B 571 68.911 24.195 5.457 1.00 0.00 O ATOM 2010 OE2 GLU B 571 68.087 25.376 7.059 1.00 0.00 O ATOM 0 H GLU B 571 65.517 22.170 8.351 1.00 0.00 H new ATOM 0 HA GLU B 571 67.707 20.322 7.555 1.00 0.00 H new ATOM 0 HB2 GLU B 571 68.007 23.025 8.921 1.00 0.00 H new ATOM 0 HB3 GLU B 571 69.090 22.261 7.775 1.00 0.00 H new ATOM 0 HG2 GLU B 571 67.188 22.460 6.037 1.00 0.00 H new ATOM 0 HG3 GLU B 571 66.354 23.481 7.193 1.00 0.00 H new ATOM 2017 N HIS B 572 67.118 21.323 10.642 1.00 0.00 N ATOM 2018 CA HIS B 572 67.380 20.946 12.063 1.00 0.00 C ATOM 2019 C HIS B 572 66.856 19.536 12.331 1.00 0.00 C ATOM 2020 O HIS B 572 67.047 18.986 13.398 1.00 0.00 O ATOM 2021 CB HIS B 572 66.724 21.976 12.995 1.00 0.00 C ATOM 2022 CG HIS B 572 67.173 23.349 12.546 1.00 0.00 C ATOM 2023 ND1 HIS B 572 66.494 24.546 12.831 1.00 0.00 N ATOM 2024 CD2 HIS B 572 68.267 23.724 11.801 1.00 0.00 C ATOM 2025 CE1 HIS B 572 67.196 25.543 12.259 1.00 0.00 C ATOM 2026 NE2 HIS B 572 68.277 25.099 11.624 1.00 0.00 N ATOM 0 H HIS B 572 66.528 22.145 10.510 1.00 0.00 H new ATOM 0 HA HIS B 572 68.453 20.946 12.255 1.00 0.00 H new ATOM 0 HB2 HIS B 572 65.638 21.895 12.952 1.00 0.00 H new ATOM 0 HB3 HIS B 572 67.016 21.797 14.030 1.00 0.00 H new ATOM 0 HD2 HIS B 572 69.011 23.045 11.410 1.00 0.00 H new ATOM 0 HE1 HIS B 572 66.913 26.584 12.310 1.00 0.00 H new ATOM 0 HE2 HIS B 572 68.967 25.652 11.115 1.00 0.00 H new ATOM 2033 N PHE B 573 66.226 18.934 11.355 1.00 0.00 N ATOM 2034 CA PHE B 573 65.715 17.537 11.516 1.00 0.00 C ATOM 2035 C PHE B 573 66.185 16.722 10.306 1.00 0.00 C ATOM 2036 O PHE B 573 65.399 16.181 9.554 1.00 0.00 O ATOM 2037 CB PHE B 573 64.189 17.562 11.570 1.00 0.00 C ATOM 2038 CG PHE B 573 63.671 16.282 12.186 1.00 0.00 C ATOM 2039 CD1 PHE B 573 63.228 15.239 11.365 1.00 0.00 C ATOM 2040 CD2 PHE B 573 63.632 16.142 13.578 1.00 0.00 C ATOM 2041 CE1 PHE B 573 62.746 14.055 11.935 1.00 0.00 C ATOM 2042 CE2 PHE B 573 63.150 14.958 14.149 1.00 0.00 C ATOM 2043 CZ PHE B 573 62.707 13.915 13.328 1.00 0.00 C ATOM 0 H PHE B 573 66.041 19.354 10.444 1.00 0.00 H new ATOM 0 HA PHE B 573 66.090 17.090 12.437 1.00 0.00 H new ATOM 0 HB2 PHE B 573 63.852 18.418 12.154 1.00 0.00 H new ATOM 0 HB3 PHE B 573 63.783 17.682 10.565 1.00 0.00 H new ATOM 0 HD1 PHE B 573 63.258 15.348 10.291 1.00 0.00 H new ATOM 0 HD2 PHE B 573 63.974 16.947 14.212 1.00 0.00 H new ATOM 0 HE1 PHE B 573 62.404 13.250 11.301 1.00 0.00 H new ATOM 0 HE2 PHE B 573 63.120 14.850 15.223 1.00 0.00 H new ATOM 0 HZ PHE B 573 62.335 13.002 13.769 1.00 0.00 H new ATOM 2053 N VAL B 574 67.472 16.670 10.108 1.00 0.00 N ATOM 2054 CA VAL B 574 68.050 15.938 8.943 1.00 0.00 C ATOM 2055 C VAL B 574 68.437 14.501 9.327 1.00 0.00 C ATOM 2056 O VAL B 574 68.317 14.089 10.463 1.00 0.00 O ATOM 2057 CB VAL B 574 69.321 16.655 8.486 1.00 0.00 C ATOM 2058 CG1 VAL B 574 68.962 18.021 7.865 1.00 0.00 C ATOM 2059 CG2 VAL B 574 70.250 16.841 9.696 1.00 0.00 C ATOM 0 H VAL B 574 68.162 17.112 10.715 1.00 0.00 H new ATOM 0 HA VAL B 574 67.299 15.912 8.153 1.00 0.00 H new ATOM 0 HB VAL B 574 69.830 16.059 7.728 1.00 0.00 H new ATOM 0 HG11 VAL B 574 69.873 18.525 7.542 1.00 0.00 H new ATOM 0 HG12 VAL B 574 68.308 17.870 7.007 1.00 0.00 H new ATOM 0 HG13 VAL B 574 68.451 18.635 8.607 1.00 0.00 H new ATOM 0 HG21 VAL B 574 71.160 17.352 9.381 1.00 0.00 H new ATOM 0 HG22 VAL B 574 69.744 17.437 10.455 1.00 0.00 H new ATOM 0 HG23 VAL B 574 70.506 15.866 10.111 1.00 0.00 H new ATOM 2069 N CYS B 575 68.919 13.752 8.369 1.00 0.00 N ATOM 2070 CA CYS B 575 69.348 12.340 8.628 1.00 0.00 C ATOM 2071 C CYS B 575 70.748 12.369 9.210 1.00 0.00 C ATOM 2072 O CYS B 575 71.549 13.198 8.823 1.00 0.00 O ATOM 2073 CB CYS B 575 69.347 11.565 7.291 1.00 0.00 C ATOM 2074 SG CYS B 575 70.901 10.666 7.029 1.00 0.00 S ATOM 0 H CYS B 575 69.036 14.061 7.404 1.00 0.00 H new ATOM 0 HA CYS B 575 68.669 11.849 9.326 1.00 0.00 H new ATOM 0 HB2 CYS B 575 68.514 10.862 7.280 1.00 0.00 H new ATOM 0 HB3 CYS B 575 69.187 12.261 6.468 1.00 0.00 H new ATOM 2079 N ALA B 576 71.090 11.472 10.112 1.00 0.00 N ATOM 2080 CA ALA B 576 72.490 11.533 10.624 1.00 0.00 C ATOM 2081 C ALA B 576 73.378 10.580 9.793 1.00 0.00 C ATOM 2082 O ALA B 576 73.856 9.566 10.256 1.00 0.00 O ATOM 2083 CB ALA B 576 72.465 11.081 12.102 1.00 0.00 C ATOM 0 H ALA B 576 70.493 10.740 10.495 1.00 0.00 H new ATOM 0 HA ALA B 576 72.894 12.542 10.544 1.00 0.00 H new ATOM 0 HB1 ALA B 576 73.475 11.113 12.510 1.00 0.00 H new ATOM 0 HB2 ALA B 576 71.821 11.748 12.675 1.00 0.00 H new ATOM 0 HB3 ALA B 576 72.081 10.063 12.165 1.00 0.00 H new ATOM 2089 N PHE B 577 73.686 11.021 8.603 1.00 0.00 N ATOM 2090 CA PHE B 577 74.643 10.345 7.666 1.00 0.00 C ATOM 2091 C PHE B 577 75.142 11.502 6.831 1.00 0.00 C ATOM 2092 O PHE B 577 76.276 11.935 6.879 1.00 0.00 O ATOM 2093 CB PHE B 577 73.959 9.299 6.774 1.00 0.00 C ATOM 2094 CG PHE B 577 74.967 8.665 5.830 1.00 0.00 C ATOM 2095 CD1 PHE B 577 75.778 7.597 6.255 1.00 0.00 C ATOM 2096 CD2 PHE B 577 75.083 9.143 4.518 1.00 0.00 C ATOM 2097 CE1 PHE B 577 76.696 7.019 5.370 1.00 0.00 C ATOM 2098 CE2 PHE B 577 76.002 8.562 3.636 1.00 0.00 C ATOM 2099 CZ PHE B 577 76.807 7.501 4.062 1.00 0.00 C ATOM 0 H PHE B 577 73.288 11.877 8.217 1.00 0.00 H new ATOM 0 HA PHE B 577 75.422 9.792 8.192 1.00 0.00 H new ATOM 0 HB2 PHE B 577 73.498 8.530 7.393 1.00 0.00 H new ATOM 0 HB3 PHE B 577 73.160 9.768 6.200 1.00 0.00 H new ATOM 0 HD1 PHE B 577 75.692 7.223 7.264 1.00 0.00 H new ATOM 0 HD2 PHE B 577 74.462 9.962 4.186 1.00 0.00 H new ATOM 0 HE1 PHE B 577 77.319 6.200 5.698 1.00 0.00 H new ATOM 0 HE2 PHE B 577 76.089 8.934 2.626 1.00 0.00 H new ATOM 0 HZ PHE B 577 77.515 7.053 3.380 1.00 0.00 H new ATOM 2109 N CYS B 578 74.181 12.038 6.112 1.00 0.00 N ATOM 2110 CA CYS B 578 74.358 13.238 5.262 1.00 0.00 C ATOM 2111 C CYS B 578 73.478 14.308 5.917 1.00 0.00 C ATOM 2112 O CYS B 578 72.351 14.535 5.535 1.00 0.00 O ATOM 2113 CB CYS B 578 73.858 12.951 3.840 1.00 0.00 C ATOM 2114 SG CYS B 578 72.120 12.444 3.893 1.00 0.00 S ATOM 0 H CYS B 578 73.233 11.661 6.088 1.00 0.00 H new ATOM 0 HA CYS B 578 75.401 13.544 5.186 1.00 0.00 H new ATOM 0 HB2 CYS B 578 73.968 13.840 3.219 1.00 0.00 H new ATOM 0 HB3 CYS B 578 74.462 12.167 3.384 1.00 0.00 H new ATOM 2119 N LEU B 579 73.970 14.897 6.958 1.00 0.00 N ATOM 2120 CA LEU B 579 73.189 15.898 7.735 1.00 0.00 C ATOM 2121 C LEU B 579 72.610 17.031 6.871 1.00 0.00 C ATOM 2122 O LEU B 579 72.231 18.052 7.409 1.00 0.00 O ATOM 2123 CB LEU B 579 74.116 16.489 8.802 1.00 0.00 C ATOM 2124 CG LEU B 579 74.553 15.372 9.784 1.00 0.00 C ATOM 2125 CD1 LEU B 579 75.948 15.678 10.348 1.00 0.00 C ATOM 2126 CD2 LEU B 579 73.544 15.270 10.939 1.00 0.00 C ATOM 0 H LEU B 579 74.909 14.725 7.318 1.00 0.00 H new ATOM 0 HA LEU B 579 72.333 15.387 8.175 1.00 0.00 H new ATOM 0 HB2 LEU B 579 74.991 16.937 8.331 1.00 0.00 H new ATOM 0 HB3 LEU B 579 73.604 17.284 9.344 1.00 0.00 H new ATOM 0 HG LEU B 579 74.586 14.425 9.246 1.00 0.00 H new ATOM 0 HD11 LEU B 579 76.244 14.886 11.036 1.00 0.00 H new ATOM 0 HD12 LEU B 579 76.667 15.735 9.530 1.00 0.00 H new ATOM 0 HD13 LEU B 579 75.925 16.630 10.878 1.00 0.00 H new ATOM 0 HD21 LEU B 579 73.856 14.483 11.626 1.00 0.00 H new ATOM 0 HD22 LEU B 579 73.502 16.221 11.471 1.00 0.00 H new ATOM 0 HD23 LEU B 579 72.557 15.033 10.540 1.00 0.00 H new ATOM 2138 N LYS B 580 72.538 16.917 5.555 1.00 0.00 N ATOM 2139 CA LYS B 580 71.981 18.083 4.783 1.00 0.00 C ATOM 2140 C LYS B 580 70.452 18.007 4.625 1.00 0.00 C ATOM 2141 O LYS B 580 69.791 19.025 4.679 1.00 0.00 O ATOM 2142 CB LYS B 580 72.666 18.149 3.384 1.00 0.00 C ATOM 2143 CG LYS B 580 71.894 17.378 2.281 1.00 0.00 C ATOM 2144 CD LYS B 580 72.006 15.866 2.513 1.00 0.00 C ATOM 2145 CE LYS B 580 70.825 15.148 1.855 1.00 0.00 C ATOM 2146 NZ LYS B 580 70.474 15.833 0.579 1.00 0.00 N ATOM 0 H LYS B 580 72.826 16.107 5.006 1.00 0.00 H new ATOM 0 HA LYS B 580 72.195 18.990 5.348 1.00 0.00 H new ATOM 0 HB2 LYS B 580 72.765 19.193 3.085 1.00 0.00 H new ATOM 0 HB3 LYS B 580 73.674 17.743 3.462 1.00 0.00 H new ATOM 0 HG2 LYS B 580 70.846 17.677 2.284 1.00 0.00 H new ATOM 0 HG3 LYS B 580 72.295 17.633 1.300 1.00 0.00 H new ATOM 0 HD2 LYS B 580 72.944 15.495 2.100 1.00 0.00 H new ATOM 0 HD3 LYS B 580 72.022 15.654 3.582 1.00 0.00 H new ATOM 0 HE2 LYS B 580 71.081 14.106 1.662 1.00 0.00 H new ATOM 0 HE3 LYS B 580 69.967 15.146 2.527 1.00 0.00 H new ATOM 0 HZ1 LYS B 580 69.972 15.169 -0.045 1.00 0.00 H new ATOM 0 HZ2 LYS B 580 69.861 16.649 0.780 1.00 0.00 H new ATOM 0 HZ3 LYS B 580 71.343 16.160 0.110 1.00 0.00 H new ATOM 2160 N GLN B 581 69.849 16.849 4.446 1.00 0.00 N ATOM 2161 CA GLN B 581 68.352 16.859 4.315 1.00 0.00 C ATOM 2162 C GLN B 581 67.672 15.522 4.616 1.00 0.00 C ATOM 2163 O GLN B 581 68.104 14.467 4.195 1.00 0.00 O ATOM 2164 CB GLN B 581 67.949 17.340 2.927 1.00 0.00 C ATOM 2165 CG GLN B 581 66.454 17.684 2.915 1.00 0.00 C ATOM 2166 CD GLN B 581 66.218 19.002 3.647 1.00 0.00 C ATOM 2167 OE1 GLN B 581 66.047 20.033 3.027 1.00 0.00 O ATOM 2168 NE2 GLN B 581 66.201 19.013 4.947 1.00 0.00 N ATOM 0 H GLN B 581 70.303 15.938 4.387 1.00 0.00 H new ATOM 0 HA GLN B 581 68.001 17.549 5.082 1.00 0.00 H new ATOM 0 HB2 GLN B 581 68.536 18.216 2.650 1.00 0.00 H new ATOM 0 HB3 GLN B 581 68.161 16.567 2.188 1.00 0.00 H new ATOM 0 HG2 GLN B 581 66.098 17.760 1.888 1.00 0.00 H new ATOM 0 HG3 GLN B 581 65.885 16.886 3.392 1.00 0.00 H new ATOM 0 HE21 GLN B 581 66.345 18.147 5.466 1.00 0.00 H new ATOM 0 HE22 GLN B 581 66.044 19.888 5.448 1.00 0.00 H new ATOM 2177 N LEU B 582 66.552 15.600 5.286 1.00 0.00 N ATOM 2178 CA LEU B 582 65.724 14.393 5.581 1.00 0.00 C ATOM 2179 C LEU B 582 64.249 14.749 5.364 1.00 0.00 C ATOM 2180 O LEU B 582 63.899 15.900 5.196 1.00 0.00 O ATOM 2181 CB LEU B 582 65.945 13.984 7.028 1.00 0.00 C ATOM 2182 CG LEU B 582 65.392 12.577 7.322 1.00 0.00 C ATOM 2183 CD1 LEU B 582 66.068 11.525 6.412 1.00 0.00 C ATOM 2184 CD2 LEU B 582 65.649 12.254 8.807 1.00 0.00 C ATOM 0 H LEU B 582 66.168 16.472 5.650 1.00 0.00 H new ATOM 0 HA LEU B 582 66.004 13.568 4.926 1.00 0.00 H new ATOM 0 HB2 LEU B 582 67.011 14.008 7.253 1.00 0.00 H new ATOM 0 HB3 LEU B 582 65.464 14.707 7.686 1.00 0.00 H new ATOM 0 HG LEU B 582 64.322 12.551 7.117 1.00 0.00 H new ATOM 0 HD11 LEU B 582 65.664 10.538 6.635 1.00 0.00 H new ATOM 0 HD12 LEU B 582 65.874 11.769 5.368 1.00 0.00 H new ATOM 0 HD13 LEU B 582 67.143 11.526 6.591 1.00 0.00 H new ATOM 0 HD21 LEU B 582 65.264 11.260 9.035 1.00 0.00 H new ATOM 0 HD22 LEU B 582 66.720 12.282 9.005 1.00 0.00 H new ATOM 0 HD23 LEU B 582 65.145 12.991 9.432 1.00 0.00 H new ATOM 2196 N ASN B 583 63.384 13.771 5.368 1.00 0.00 N ATOM 2197 CA ASN B 583 61.928 14.042 5.163 1.00 0.00 C ATOM 2198 C ASN B 583 61.113 13.017 5.955 1.00 0.00 C ATOM 2199 O ASN B 583 61.346 11.828 5.872 1.00 0.00 O ATOM 2200 CB ASN B 583 61.595 13.923 3.668 1.00 0.00 C ATOM 2201 CG ASN B 583 61.945 15.219 2.945 1.00 0.00 C ATOM 2202 OD1 ASN B 583 62.228 16.226 3.564 1.00 0.00 O ATOM 2203 ND2 ASN B 583 61.932 15.234 1.645 1.00 0.00 N ATOM 0 H ASN B 583 63.623 12.789 5.505 1.00 0.00 H new ATOM 0 HA ASN B 583 61.685 15.047 5.508 1.00 0.00 H new ATOM 0 HB2 ASN B 583 62.149 13.093 3.230 1.00 0.00 H new ATOM 0 HB3 ASN B 583 60.535 13.702 3.541 1.00 0.00 H new ATOM 0 HD21 ASN B 583 62.160 16.092 1.143 1.00 0.00 H new ATOM 0 HD22 ASN B 583 61.694 14.388 1.128 1.00 0.00 H new ATOM 2210 N LYS B 584 60.155 13.471 6.715 1.00 0.00 N ATOM 2211 CA LYS B 584 59.319 12.536 7.512 1.00 0.00 C ATOM 2212 C LYS B 584 58.763 11.445 6.603 1.00 0.00 C ATOM 2213 O LYS B 584 58.304 10.415 7.053 1.00 0.00 O ATOM 2214 CB LYS B 584 58.153 13.321 8.107 1.00 0.00 C ATOM 2215 CG LYS B 584 57.418 14.106 6.979 1.00 0.00 C ATOM 2216 CD LYS B 584 55.899 13.956 7.121 1.00 0.00 C ATOM 2217 CE LYS B 584 55.415 14.686 8.376 1.00 0.00 C ATOM 2218 NZ LYS B 584 55.347 16.149 8.102 1.00 0.00 N ATOM 0 H LYS B 584 59.915 14.457 6.817 1.00 0.00 H new ATOM 0 HA LYS B 584 59.920 12.082 8.300 1.00 0.00 H new ATOM 0 HB2 LYS B 584 57.459 12.641 8.602 1.00 0.00 H new ATOM 0 HB3 LYS B 584 58.518 14.013 8.866 1.00 0.00 H new ATOM 0 HG2 LYS B 584 57.691 15.160 7.025 1.00 0.00 H new ATOM 0 HG3 LYS B 584 57.736 13.736 6.004 1.00 0.00 H new ATOM 0 HD2 LYS B 584 55.402 14.362 6.240 1.00 0.00 H new ATOM 0 HD3 LYS B 584 55.634 12.900 7.179 1.00 0.00 H new ATOM 0 HE2 LYS B 584 54.434 14.314 8.671 1.00 0.00 H new ATOM 0 HE3 LYS B 584 56.093 14.492 9.207 1.00 0.00 H new ATOM 0 HZ1 LYS B 584 55.640 16.675 8.950 1.00 0.00 H new ATOM 0 HZ2 LYS B 584 55.982 16.384 7.312 1.00 0.00 H new ATOM 0 HZ3 LYS B 584 54.372 16.410 7.852 1.00 0.00 H new ATOM 2232 N GLY B 585 58.790 11.675 5.322 1.00 0.00 N ATOM 2233 CA GLY B 585 58.257 10.671 4.367 1.00 0.00 C ATOM 2234 C GLY B 585 59.360 9.689 4.018 1.00 0.00 C ATOM 2235 O GLY B 585 59.114 8.586 3.572 1.00 0.00 O ATOM 0 H GLY B 585 59.162 12.523 4.894 1.00 0.00 H new ATOM 0 HA2 GLY B 585 57.410 10.145 4.807 1.00 0.00 H new ATOM 0 HA3 GLY B 585 57.893 11.164 3.466 1.00 0.00 H new ATOM 2239 N THR B 586 60.578 10.091 4.227 1.00 0.00 N ATOM 2240 CA THR B 586 61.740 9.208 3.926 1.00 0.00 C ATOM 2241 C THR B 586 62.696 9.242 5.108 1.00 0.00 C ATOM 2242 O THR B 586 63.887 9.048 4.964 1.00 0.00 O ATOM 2243 CB THR B 586 62.454 9.719 2.673 1.00 0.00 C ATOM 2244 OG1 THR B 586 63.394 10.717 3.045 1.00 0.00 O ATOM 2245 CG2 THR B 586 61.421 10.318 1.716 1.00 0.00 C ATOM 0 H THR B 586 60.824 11.008 4.599 1.00 0.00 H new ATOM 0 HA THR B 586 61.400 8.187 3.753 1.00 0.00 H new ATOM 0 HB THR B 586 62.973 8.897 2.180 1.00 0.00 H new ATOM 0 HG1 THR B 586 64.116 10.308 3.567 1.00 0.00 H new ATOM 0 HG21 THR B 586 61.924 10.684 0.821 1.00 0.00 H new ATOM 0 HG22 THR B 586 60.696 9.553 1.438 1.00 0.00 H new ATOM 0 HG23 THR B 586 60.906 11.144 2.207 1.00 0.00 H new ATOM 2253 N PHE B 587 62.184 9.491 6.285 1.00 0.00 N ATOM 2254 CA PHE B 587 63.076 9.541 7.484 1.00 0.00 C ATOM 2255 C PHE B 587 63.188 8.149 8.111 1.00 0.00 C ATOM 2256 O PHE B 587 62.270 7.625 8.708 1.00 0.00 O ATOM 2257 CB PHE B 587 62.553 10.563 8.513 1.00 0.00 C ATOM 2258 CG PHE B 587 61.449 9.977 9.383 1.00 0.00 C ATOM 2259 CD1 PHE B 587 60.332 9.364 8.798 1.00 0.00 C ATOM 2260 CD2 PHE B 587 61.546 10.054 10.781 1.00 0.00 C ATOM 2261 CE1 PHE B 587 59.320 8.831 9.605 1.00 0.00 C ATOM 2262 CE2 PHE B 587 60.533 9.521 11.586 1.00 0.00 C ATOM 2263 CZ PHE B 587 59.421 8.909 10.998 1.00 0.00 C ATOM 0 H PHE B 587 61.195 9.661 6.469 1.00 0.00 H new ATOM 0 HA PHE B 587 64.068 9.863 7.168 1.00 0.00 H new ATOM 0 HB2 PHE B 587 63.376 10.895 9.146 1.00 0.00 H new ATOM 0 HB3 PHE B 587 62.176 11.443 7.992 1.00 0.00 H new ATOM 0 HD1 PHE B 587 60.252 9.303 7.723 1.00 0.00 H new ATOM 0 HD2 PHE B 587 62.404 10.526 11.236 1.00 0.00 H new ATOM 0 HE1 PHE B 587 58.461 8.359 9.152 1.00 0.00 H new ATOM 0 HE2 PHE B 587 60.610 9.582 12.662 1.00 0.00 H new ATOM 0 HZ PHE B 587 58.640 8.497 11.620 1.00 0.00 H new ATOM 2273 N LYS B 588 64.333 7.556 7.965 1.00 0.00 N ATOM 2274 CA LYS B 588 64.591 6.202 8.526 1.00 0.00 C ATOM 2275 C LYS B 588 65.405 6.393 9.811 1.00 0.00 C ATOM 2276 O LYS B 588 65.873 7.476 10.092 1.00 0.00 O ATOM 2277 CB LYS B 588 65.373 5.395 7.458 1.00 0.00 C ATOM 2278 CG LYS B 588 64.802 3.970 7.228 1.00 0.00 C ATOM 2279 CD LYS B 588 63.269 3.921 7.000 1.00 0.00 C ATOM 2280 CE LYS B 588 62.749 5.141 6.225 1.00 0.00 C ATOM 2281 NZ LYS B 588 61.536 4.748 5.455 1.00 0.00 N ATOM 0 H LYS B 588 65.125 7.963 7.467 1.00 0.00 H new ATOM 0 HA LYS B 588 63.678 5.658 8.767 1.00 0.00 H new ATOM 0 HB2 LYS B 588 65.357 5.942 6.515 1.00 0.00 H new ATOM 0 HB3 LYS B 588 66.416 5.316 7.764 1.00 0.00 H new ATOM 0 HG2 LYS B 588 65.299 3.528 6.365 1.00 0.00 H new ATOM 0 HG3 LYS B 588 65.048 3.350 8.090 1.00 0.00 H new ATOM 0 HD2 LYS B 588 63.015 3.013 6.454 1.00 0.00 H new ATOM 0 HD3 LYS B 588 62.763 3.865 7.964 1.00 0.00 H new ATOM 0 HE2 LYS B 588 62.511 5.951 6.914 1.00 0.00 H new ATOM 0 HE3 LYS B 588 63.519 5.514 5.549 1.00 0.00 H new ATOM 0 HZ1 LYS B 588 61.178 5.570 4.927 1.00 0.00 H new ATOM 0 HZ2 LYS B 588 61.779 3.988 4.788 1.00 0.00 H new ATOM 0 HZ3 LYS B 588 60.802 4.412 6.111 1.00 0.00 H new ATOM 2295 N GLU B 589 65.558 5.375 10.609 1.00 0.00 N ATOM 2296 CA GLU B 589 66.323 5.551 11.881 1.00 0.00 C ATOM 2297 C GLU B 589 66.953 4.234 12.317 1.00 0.00 C ATOM 2298 O GLU B 589 66.516 3.154 11.973 1.00 0.00 O ATOM 2299 CB GLU B 589 65.377 6.079 12.977 1.00 0.00 C ATOM 2300 CG GLU B 589 65.939 5.805 14.381 1.00 0.00 C ATOM 2301 CD GLU B 589 65.149 6.615 15.411 1.00 0.00 C ATOM 2302 OE1 GLU B 589 65.388 7.808 15.508 1.00 0.00 O ATOM 2303 OE2 GLU B 589 64.317 6.029 16.085 1.00 0.00 O ATOM 0 H GLU B 589 65.193 4.437 10.442 1.00 0.00 H new ATOM 0 HA GLU B 589 67.125 6.271 11.716 1.00 0.00 H new ATOM 0 HB2 GLU B 589 65.228 7.151 12.846 1.00 0.00 H new ATOM 0 HB3 GLU B 589 64.400 5.606 12.876 1.00 0.00 H new ATOM 0 HG2 GLU B 589 65.873 4.741 14.610 1.00 0.00 H new ATOM 0 HG3 GLU B 589 66.994 6.075 14.421 1.00 0.00 H new ATOM 2310 N GLN B 590 67.974 4.354 13.103 1.00 0.00 N ATOM 2311 CA GLN B 590 68.686 3.178 13.643 1.00 0.00 C ATOM 2312 C GLN B 590 69.359 3.629 14.935 1.00 0.00 C ATOM 2313 O GLN B 590 69.788 4.758 15.049 1.00 0.00 O ATOM 2314 CB GLN B 590 69.747 2.690 12.641 1.00 0.00 C ATOM 2315 CG GLN B 590 70.074 1.205 12.898 1.00 0.00 C ATOM 2316 CD GLN B 590 69.137 0.308 12.084 1.00 0.00 C ATOM 2317 OE1 GLN B 590 67.956 0.577 11.979 1.00 0.00 O ATOM 2318 NE2 GLN B 590 69.621 -0.754 11.501 1.00 0.00 N ATOM 0 H GLN B 590 68.357 5.250 13.403 1.00 0.00 H new ATOM 0 HA GLN B 590 67.996 2.354 13.823 1.00 0.00 H new ATOM 0 HB2 GLN B 590 69.383 2.819 11.622 1.00 0.00 H new ATOM 0 HB3 GLN B 590 70.651 3.291 12.735 1.00 0.00 H new ATOM 0 HG2 GLN B 590 71.110 1.001 12.628 1.00 0.00 H new ATOM 0 HG3 GLN B 590 69.972 0.981 13.960 1.00 0.00 H new ATOM 0 HE21 GLN B 590 70.612 -0.978 11.590 1.00 0.00 H new ATOM 0 HE22 GLN B 590 69.008 -1.360 10.956 1.00 0.00 H new ATOM 2327 N ASN B 591 69.458 2.773 15.906 1.00 0.00 N ATOM 2328 CA ASN B 591 70.103 3.166 17.193 1.00 0.00 C ATOM 2329 C ASN B 591 69.590 4.551 17.638 1.00 0.00 C ATOM 2330 O ASN B 591 70.243 5.236 18.394 1.00 0.00 O ATOM 2331 CB ASN B 591 71.647 3.174 17.050 1.00 0.00 C ATOM 2332 CG ASN B 591 72.048 3.343 15.591 1.00 0.00 C ATOM 2333 OD1 ASN B 591 72.665 4.321 15.221 1.00 0.00 O ATOM 2334 ND2 ASN B 591 71.716 2.417 14.747 1.00 0.00 N ATOM 0 H ASN B 591 69.120 1.812 15.868 1.00 0.00 H new ATOM 0 HA ASN B 591 69.839 2.434 17.956 1.00 0.00 H new ATOM 0 HB2 ASN B 591 72.069 3.984 17.645 1.00 0.00 H new ATOM 0 HB3 ASN B 591 72.059 2.244 17.441 1.00 0.00 H new ATOM 0 HD21 ASN B 591 71.973 2.507 13.764 1.00 0.00 H new ATOM 0 HD22 ASN B 591 71.198 1.598 15.066 1.00 0.00 H new ATOM 2341 N ASP B 592 68.415 4.944 17.181 1.00 0.00 N ATOM 2342 CA ASP B 592 67.810 6.268 17.574 1.00 0.00 C ATOM 2343 C ASP B 592 68.360 7.399 16.702 1.00 0.00 C ATOM 2344 O ASP B 592 67.922 8.529 16.788 1.00 0.00 O ATOM 2345 CB ASP B 592 68.110 6.590 19.044 1.00 0.00 C ATOM 2346 CG ASP B 592 68.033 5.315 19.888 1.00 0.00 C ATOM 2347 OD1 ASP B 592 68.860 5.161 20.771 1.00 0.00 O ATOM 2348 OD2 ASP B 592 67.148 4.513 19.635 1.00 0.00 O ATOM 0 H ASP B 592 67.841 4.394 16.542 1.00 0.00 H new ATOM 0 HA ASP B 592 66.732 6.188 17.430 1.00 0.00 H new ATOM 0 HB2 ASP B 592 69.101 7.034 19.132 1.00 0.00 H new ATOM 0 HB3 ASP B 592 67.397 7.325 19.416 1.00 0.00 H new ATOM 2353 N LYS B 593 69.317 7.110 15.880 1.00 0.00 N ATOM 2354 CA LYS B 593 69.907 8.161 15.016 1.00 0.00 C ATOM 2355 C LYS B 593 69.105 8.261 13.705 1.00 0.00 C ATOM 2356 O LYS B 593 69.052 7.303 12.960 1.00 0.00 O ATOM 2357 CB LYS B 593 71.331 7.749 14.679 1.00 0.00 C ATOM 2358 CG LYS B 593 72.108 7.419 15.959 1.00 0.00 C ATOM 2359 CD LYS B 593 73.614 7.519 15.680 1.00 0.00 C ATOM 2360 CE LYS B 593 74.402 7.277 16.971 1.00 0.00 C ATOM 2361 NZ LYS B 593 74.406 8.521 17.790 1.00 0.00 N ATOM 0 H LYS B 593 69.722 6.181 15.766 1.00 0.00 H new ATOM 0 HA LYS B 593 69.888 9.122 15.531 1.00 0.00 H new ATOM 0 HB2 LYS B 593 71.319 6.881 14.019 1.00 0.00 H new ATOM 0 HB3 LYS B 593 71.831 8.553 14.139 1.00 0.00 H new ATOM 0 HG2 LYS B 593 71.828 8.108 16.756 1.00 0.00 H new ATOM 0 HG3 LYS B 593 71.856 6.416 16.302 1.00 0.00 H new ATOM 0 HD2 LYS B 593 73.902 6.787 14.926 1.00 0.00 H new ATOM 0 HD3 LYS B 593 73.853 8.503 15.277 1.00 0.00 H new ATOM 0 HE2 LYS B 593 73.954 6.459 17.535 1.00 0.00 H new ATOM 0 HE3 LYS B 593 75.424 6.980 16.736 1.00 0.00 H new ATOM 0 HZ1 LYS B 593 74.969 8.368 18.651 1.00 0.00 H new ATOM 0 HZ2 LYS B 593 74.821 9.299 17.238 1.00 0.00 H new ATOM 0 HZ3 LYS B 593 73.430 8.766 18.054 1.00 0.00 H new ATOM 2375 N PRO B 594 68.491 9.388 13.388 1.00 0.00 N ATOM 2376 CA PRO B 594 67.731 9.488 12.112 1.00 0.00 C ATOM 2377 C PRO B 594 68.557 8.994 10.916 1.00 0.00 C ATOM 2378 O PRO B 594 69.754 8.815 11.013 1.00 0.00 O ATOM 2379 CB PRO B 594 67.452 10.992 12.034 1.00 0.00 C ATOM 2380 CG PRO B 594 67.558 11.552 13.452 1.00 0.00 C ATOM 2381 CD PRO B 594 68.492 10.619 14.237 1.00 0.00 C ATOM 0 HA PRO B 594 66.832 8.873 12.084 1.00 0.00 H new ATOM 0 HB2 PRO B 594 68.168 11.481 11.374 1.00 0.00 H new ATOM 0 HB3 PRO B 594 66.460 11.177 11.622 1.00 0.00 H new ATOM 0 HG2 PRO B 594 67.952 12.568 13.436 1.00 0.00 H new ATOM 0 HG3 PRO B 594 66.576 11.599 13.922 1.00 0.00 H new ATOM 0 HD2 PRO B 594 69.492 11.039 14.344 1.00 0.00 H new ATOM 0 HD3 PRO B 594 68.120 10.421 15.242 1.00 0.00 H new ATOM 2389 N TYR B 595 67.928 8.757 9.798 1.00 0.00 N ATOM 2390 CA TYR B 595 68.692 8.256 8.617 1.00 0.00 C ATOM 2391 C TYR B 595 67.811 8.265 7.367 1.00 0.00 C ATOM 2392 O TYR B 595 66.694 7.797 7.394 1.00 0.00 O ATOM 2393 CB TYR B 595 69.101 6.788 8.857 1.00 0.00 C ATOM 2394 CG TYR B 595 70.399 6.666 9.628 1.00 0.00 C ATOM 2395 CD1 TYR B 595 70.430 5.991 10.857 1.00 0.00 C ATOM 2396 CD2 TYR B 595 71.579 7.181 9.090 1.00 0.00 C ATOM 2397 CE1 TYR B 595 71.641 5.838 11.541 1.00 0.00 C ATOM 2398 CE2 TYR B 595 72.790 7.031 9.782 1.00 0.00 C ATOM 2399 CZ TYR B 595 72.818 6.359 11.004 1.00 0.00 C ATOM 2400 OH TYR B 595 74.012 6.209 11.681 1.00 0.00 O ATOM 0 H TYR B 595 66.927 8.887 9.650 1.00 0.00 H new ATOM 0 HA TYR B 595 69.561 8.900 8.481 1.00 0.00 H new ATOM 0 HB2 TYR B 595 68.308 6.278 9.404 1.00 0.00 H new ATOM 0 HB3 TYR B 595 69.203 6.281 7.897 1.00 0.00 H new ATOM 0 HD1 TYR B 595 69.519 5.589 11.275 1.00 0.00 H new ATOM 0 HD2 TYR B 595 71.560 7.695 8.140 1.00 0.00 H new ATOM 0 HE1 TYR B 595 71.664 5.316 12.486 1.00 0.00 H new ATOM 0 HE2 TYR B 595 73.702 7.436 9.368 1.00 0.00 H new ATOM 0 HH TYR B 595 74.734 6.629 11.168 1.00 0.00 H new ATOM 2410 N CYS B 596 68.328 8.683 6.248 1.00 0.00 N ATOM 2411 CA CYS B 596 67.512 8.573 5.015 1.00 0.00 C ATOM 2412 C CYS B 596 67.458 7.089 4.736 1.00 0.00 C ATOM 2413 O CYS B 596 68.334 6.355 5.151 1.00 0.00 O ATOM 2414 CB CYS B 596 68.169 9.274 3.818 1.00 0.00 C ATOM 2415 SG CYS B 596 68.682 10.948 4.249 1.00 0.00 S ATOM 0 H CYS B 596 69.258 9.087 6.135 1.00 0.00 H new ATOM 0 HA CYS B 596 66.537 9.040 5.152 1.00 0.00 H new ATOM 0 HB2 CYS B 596 69.034 8.699 3.486 1.00 0.00 H new ATOM 0 HB3 CYS B 596 67.469 9.308 2.983 1.00 0.00 H new ATOM 2420 N GLN B 597 66.480 6.612 4.047 1.00 0.00 N ATOM 2421 CA GLN B 597 66.472 5.161 3.788 1.00 0.00 C ATOM 2422 C GLN B 597 67.766 4.833 3.037 1.00 0.00 C ATOM 2423 O GLN B 597 68.565 4.033 3.476 1.00 0.00 O ATOM 2424 CB GLN B 597 65.200 4.796 2.987 1.00 0.00 C ATOM 2425 CG GLN B 597 65.400 3.550 2.104 1.00 0.00 C ATOM 2426 CD GLN B 597 65.126 2.288 2.918 1.00 0.00 C ATOM 2427 OE1 GLN B 597 64.677 1.290 2.389 1.00 0.00 O ATOM 2428 NE2 GLN B 597 65.382 2.295 4.190 1.00 0.00 N ATOM 0 H GLN B 597 65.702 7.146 3.659 1.00 0.00 H new ATOM 0 HA GLN B 597 66.441 4.572 4.705 1.00 0.00 H new ATOM 0 HB2 GLN B 597 64.376 4.619 3.679 1.00 0.00 H new ATOM 0 HB3 GLN B 597 64.914 5.640 2.360 1.00 0.00 H new ATOM 0 HG2 GLN B 597 64.731 3.591 1.244 1.00 0.00 H new ATOM 0 HG3 GLN B 597 66.418 3.529 1.715 1.00 0.00 H new ATOM 0 HE21 GLN B 597 65.759 3.135 4.630 1.00 0.00 H new ATOM 0 HE22 GLN B 597 65.207 1.461 4.750 1.00 0.00 H new ATOM 2437 N ASN B 598 67.978 5.459 1.915 1.00 0.00 N ATOM 2438 CA ASN B 598 69.216 5.198 1.126 1.00 0.00 C ATOM 2439 C ASN B 598 70.426 5.198 2.058 1.00 0.00 C ATOM 2440 O ASN B 598 71.402 4.514 1.824 1.00 0.00 O ATOM 2441 CB ASN B 598 69.373 6.288 0.053 1.00 0.00 C ATOM 2442 CG ASN B 598 67.998 6.753 -0.404 1.00 0.00 C ATOM 2443 OD1 ASN B 598 67.680 7.924 -0.341 1.00 0.00 O ATOM 2444 ND2 ASN B 598 67.167 5.873 -0.865 1.00 0.00 N ATOM 0 H ASN B 598 67.344 6.145 1.506 1.00 0.00 H new ATOM 0 HA ASN B 598 69.145 4.225 0.640 1.00 0.00 H new ATOM 0 HB2 ASN B 598 69.938 7.129 0.454 1.00 0.00 H new ATOM 0 HB3 ASN B 598 69.938 5.900 -0.795 1.00 0.00 H new ATOM 0 HD21 ASN B 598 66.240 6.162 -1.178 1.00 0.00 H new ATOM 0 HD22 ASN B 598 67.440 4.891 -0.915 1.00 0.00 H new ATOM 2451 N CYS B 599 70.365 5.947 3.119 1.00 0.00 N ATOM 2452 CA CYS B 599 71.503 5.972 4.064 1.00 0.00 C ATOM 2453 C CYS B 599 71.424 4.739 4.962 1.00 0.00 C ATOM 2454 O CYS B 599 72.267 3.875 4.901 1.00 0.00 O ATOM 2455 CB CYS B 599 71.428 7.237 4.920 1.00 0.00 C ATOM 2456 SG CYS B 599 71.700 8.691 3.878 1.00 0.00 S ATOM 0 H CYS B 599 69.575 6.542 3.370 1.00 0.00 H new ATOM 0 HA CYS B 599 72.444 5.969 3.514 1.00 0.00 H new ATOM 0 HB2 CYS B 599 70.455 7.302 5.406 1.00 0.00 H new ATOM 0 HB3 CYS B 599 72.177 7.198 5.711 1.00 0.00 H new ATOM 2461 N PHE B 600 70.407 4.653 5.783 1.00 0.00 N ATOM 2462 CA PHE B 600 70.255 3.483 6.700 1.00 0.00 C ATOM 2463 C PHE B 600 70.362 2.177 5.907 1.00 0.00 C ATOM 2464 O PHE B 600 71.166 1.321 6.218 1.00 0.00 O ATOM 2465 CB PHE B 600 68.881 3.592 7.409 1.00 0.00 C ATOM 2466 CG PHE B 600 68.226 2.234 7.578 1.00 0.00 C ATOM 2467 CD1 PHE B 600 67.419 1.722 6.557 1.00 0.00 C ATOM 2468 CD2 PHE B 600 68.425 1.496 8.748 1.00 0.00 C ATOM 2469 CE1 PHE B 600 66.811 0.471 6.704 1.00 0.00 C ATOM 2470 CE2 PHE B 600 67.817 0.243 8.897 1.00 0.00 C ATOM 2471 CZ PHE B 600 67.009 -0.268 7.875 1.00 0.00 C ATOM 0 H PHE B 600 69.668 5.352 5.857 1.00 0.00 H new ATOM 0 HA PHE B 600 71.048 3.482 7.448 1.00 0.00 H new ATOM 0 HB2 PHE B 600 69.012 4.057 8.386 1.00 0.00 H new ATOM 0 HB3 PHE B 600 68.225 4.243 6.832 1.00 0.00 H new ATOM 0 HD1 PHE B 600 67.265 2.293 5.654 1.00 0.00 H new ATOM 0 HD2 PHE B 600 69.047 1.892 9.537 1.00 0.00 H new ATOM 0 HE1 PHE B 600 66.189 0.076 5.914 1.00 0.00 H new ATOM 0 HE2 PHE B 600 67.972 -0.329 9.800 1.00 0.00 H new ATOM 0 HZ PHE B 600 66.538 -1.233 7.990 1.00 0.00 H new ATOM 2481 N LEU B 601 69.547 2.008 4.904 1.00 0.00 N ATOM 2482 CA LEU B 601 69.596 0.749 4.111 1.00 0.00 C ATOM 2483 C LEU B 601 71.054 0.438 3.770 1.00 0.00 C ATOM 2484 O LEU B 601 71.480 -0.700 3.778 1.00 0.00 O ATOM 2485 CB LEU B 601 68.713 0.928 2.843 1.00 0.00 C ATOM 2486 CG LEU B 601 69.539 1.008 1.531 1.00 0.00 C ATOM 2487 CD1 LEU B 601 70.186 -0.362 1.200 1.00 0.00 C ATOM 2488 CD2 LEU B 601 68.612 1.425 0.378 1.00 0.00 C ATOM 0 H LEU B 601 68.849 2.687 4.599 1.00 0.00 H new ATOM 0 HA LEU B 601 69.202 -0.096 4.675 1.00 0.00 H new ATOM 0 HB2 LEU B 601 68.013 0.095 2.774 1.00 0.00 H new ATOM 0 HB3 LEU B 601 68.119 1.836 2.947 1.00 0.00 H new ATOM 0 HG LEU B 601 70.334 1.742 1.662 1.00 0.00 H new ATOM 0 HD11 LEU B 601 70.759 -0.280 0.277 1.00 0.00 H new ATOM 0 HD12 LEU B 601 70.849 -0.657 2.013 1.00 0.00 H new ATOM 0 HD13 LEU B 601 69.405 -1.113 1.077 1.00 0.00 H new ATOM 0 HD21 LEU B 601 69.186 1.483 -0.547 1.00 0.00 H new ATOM 0 HD22 LEU B 601 67.817 0.688 0.266 1.00 0.00 H new ATOM 0 HD23 LEU B 601 68.176 2.400 0.596 1.00 0.00 H new ATOM 2500 N LYS B 602 71.813 1.445 3.460 1.00 0.00 N ATOM 2501 CA LYS B 602 73.245 1.210 3.104 1.00 0.00 C ATOM 2502 C LYS B 602 74.037 0.730 4.335 1.00 0.00 C ATOM 2503 O LYS B 602 75.105 0.178 4.196 1.00 0.00 O ATOM 2504 CB LYS B 602 73.882 2.517 2.553 1.00 0.00 C ATOM 2505 CG LYS B 602 74.054 2.453 1.024 1.00 0.00 C ATOM 2506 CD LYS B 602 74.988 3.587 0.557 1.00 0.00 C ATOM 2507 CE LYS B 602 76.448 3.115 0.596 1.00 0.00 C ATOM 2508 NZ LYS B 602 77.354 4.297 0.639 1.00 0.00 N ATOM 0 H LYS B 602 71.511 2.419 3.436 1.00 0.00 H new ATOM 0 HA LYS B 602 73.284 0.438 2.336 1.00 0.00 H new ATOM 0 HB2 LYS B 602 73.255 3.369 2.815 1.00 0.00 H new ATOM 0 HB3 LYS B 602 74.852 2.678 3.024 1.00 0.00 H new ATOM 0 HG2 LYS B 602 74.467 1.487 0.735 1.00 0.00 H new ATOM 0 HG3 LYS B 602 73.084 2.544 0.535 1.00 0.00 H new ATOM 0 HD2 LYS B 602 74.723 3.894 -0.455 1.00 0.00 H new ATOM 0 HD3 LYS B 602 74.862 4.460 1.198 1.00 0.00 H new ATOM 0 HE2 LYS B 602 76.614 2.485 1.470 1.00 0.00 H new ATOM 0 HE3 LYS B 602 76.668 2.507 -0.282 1.00 0.00 H new ATOM 0 HZ1 LYS B 602 78.333 3.979 0.785 1.00 0.00 H new ATOM 0 HZ2 LYS B 602 77.289 4.817 -0.259 1.00 0.00 H new ATOM 0 HZ3 LYS B 602 77.073 4.922 1.422 1.00 0.00 H new ATOM 2522 N LEU B 603 73.559 0.964 5.533 1.00 0.00 N ATOM 2523 CA LEU B 603 74.345 0.539 6.742 1.00 0.00 C ATOM 2524 C LEU B 603 73.975 -0.880 7.197 1.00 0.00 C ATOM 2525 O LEU B 603 74.829 -1.735 7.311 1.00 0.00 O ATOM 2526 CB LEU B 603 74.081 1.521 7.888 1.00 0.00 C ATOM 2527 CG LEU B 603 74.054 2.948 7.343 1.00 0.00 C ATOM 2528 CD1 LEU B 603 73.991 3.947 8.500 1.00 0.00 C ATOM 2529 CD2 LEU B 603 75.309 3.214 6.508 1.00 0.00 C ATOM 0 H LEU B 603 72.670 1.425 5.729 1.00 0.00 H new ATOM 0 HA LEU B 603 75.401 0.540 6.471 1.00 0.00 H new ATOM 0 HB2 LEU B 603 73.132 1.287 8.370 1.00 0.00 H new ATOM 0 HB3 LEU B 603 74.856 1.426 8.648 1.00 0.00 H new ATOM 0 HG LEU B 603 73.172 3.067 6.714 1.00 0.00 H new ATOM 0 HD11 LEU B 603 73.972 4.962 8.104 1.00 0.00 H new ATOM 0 HD12 LEU B 603 73.089 3.769 9.086 1.00 0.00 H new ATOM 0 HD13 LEU B 603 74.867 3.822 9.136 1.00 0.00 H new ATOM 0 HD21 LEU B 603 75.281 4.234 6.124 1.00 0.00 H new ATOM 0 HD22 LEU B 603 76.194 3.085 7.131 1.00 0.00 H new ATOM 0 HD23 LEU B 603 75.347 2.513 5.674 1.00 0.00 H new ATOM 2541 N PHE B 604 72.725 -1.142 7.485 1.00 0.00 N ATOM 2542 CA PHE B 604 72.343 -2.513 7.962 1.00 0.00 C ATOM 2543 C PHE B 604 71.941 -3.399 6.774 1.00 0.00 C ATOM 2544 O PHE B 604 72.104 -4.603 6.816 1.00 0.00 O ATOM 2545 CB PHE B 604 71.165 -2.398 8.953 1.00 0.00 C ATOM 2546 CG PHE B 604 71.686 -2.182 10.363 1.00 0.00 C ATOM 2547 CD1 PHE B 604 72.534 -1.101 10.641 1.00 0.00 C ATOM 2548 CD2 PHE B 604 71.318 -3.062 11.393 1.00 0.00 C ATOM 2549 CE1 PHE B 604 73.010 -0.900 11.941 1.00 0.00 C ATOM 2550 CE2 PHE B 604 71.797 -2.860 12.692 1.00 0.00 C ATOM 2551 CZ PHE B 604 72.643 -1.779 12.966 1.00 0.00 C ATOM 0 H PHE B 604 71.957 -0.475 7.413 1.00 0.00 H new ATOM 0 HA PHE B 604 73.198 -2.969 8.461 1.00 0.00 H new ATOM 0 HB2 PHE B 604 70.518 -1.569 8.666 1.00 0.00 H new ATOM 0 HB3 PHE B 604 70.559 -3.303 8.916 1.00 0.00 H new ATOM 0 HD1 PHE B 604 72.820 -0.423 9.851 1.00 0.00 H new ATOM 0 HD2 PHE B 604 70.665 -3.896 11.183 1.00 0.00 H new ATOM 0 HE1 PHE B 604 73.662 -0.065 12.154 1.00 0.00 H new ATOM 0 HE2 PHE B 604 71.514 -3.538 13.483 1.00 0.00 H new ATOM 0 HZ PHE B 604 73.013 -1.623 13.969 1.00 0.00 H new ATOM 2561 N CYS B 605 71.419 -2.820 5.720 1.00 0.00 N ATOM 2562 CA CYS B 605 71.005 -3.634 4.529 1.00 0.00 C ATOM 2563 C CYS B 605 71.942 -3.335 3.357 1.00 0.00 C ATOM 2564 O CYS B 605 71.517 -2.650 2.444 1.00 0.00 O ATOM 2565 CB CYS B 605 69.571 -3.270 4.138 1.00 0.00 C ATOM 2566 SG CYS B 605 68.454 -3.660 5.507 1.00 0.00 S ATOM 2567 OXT CYS B 605 73.069 -3.801 3.392 1.00 0.00 O ATOM 0 H CYS B 605 71.261 -1.816 5.631 1.00 0.00 H new ATOM 0 HA CYS B 605 71.058 -4.694 4.777 1.00 0.00 H new ATOM 0 HB2 CYS B 605 69.508 -2.210 3.894 1.00 0.00 H new ATOM 0 HB3 CYS B 605 69.275 -3.821 3.245 1.00 0.00 H new ATOM 0 HG CYS B 605 67.236 -3.349 5.176 1.00 0.00 H new TER 2573 CYS B 605 HETATM 2574 ZN ZN B 701 64.807 24.822 13.887 1.00 0.00 ZN HETATM 2575 ZN ZN B 702 70.911 10.677 4.731 1.00 0.00 ZN